heptyl valerate
valeric acid, heptyl ester

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  SRS Aromatics Ltd

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  CODE102612 CODE102612
  Product(s):
  HEPTYL VALERATE

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  Synerzine, Inc.

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  W01711 heptyl isovalerate

Name: heptyl pentanoate CAS Number: 5451-80-9 3D/inchi ECHA EINECS - REACH Pre-Reg: 226-686-3 FDA UNII: LR3J9VC6SC Nikkaji Web: J210.501B CoE Number: 10672 XlogP3: 4.30 (est) Molecular Weight: 200.32168000 Formula: C12 H24 O2 NMR Predictor: Predict (works with chrome, Edge or firefox) Category:fragrance agents   US / EU / FDA / JECFA / FEMA / FLAVIS / Scholar / Patent Information: Google Scholar: Search Google Books: Search Google Scholar: with word "volatile" Search Google Scholar: with word "flavor" Search Google Scholar: with word "odor" Search Perfumer and Flavorist: Search Google Patents: Search US Patents: Search EU Patents: Search Pubchem Patents: Search PubMed: Search NCBI: Search   Physical Properties: Appearance: colorless to pale yellow clear liquid (est) Assay: 98.00 to 100.00 Food Chemicals Codex Listed: No Melting Point: -46.40 °C. @ 760.00 mm Hg Boiling Point: 243.00 °C. @ 760.00 mm Hg Vapor Pressure: 0.035000 mmHg @ 25.00 °C. (est) Flash Point: 210.00 °F. TCC ( 98.89 °C. ) logP (o/w): 4.861 (est) Soluble in:   alcohol   water, 3.517 mg/L @ 25 °C (est) Insoluble in:   water Similar Items:note allyl valerate allyl isovalerate amyl valerate amyl isovalerate isoamyl valerate isoamyl isovalerate para-anisyl isovalerate para-anisyl valerate benzyl valerate benzyl isovalerate bornyl valerate bornyl isovalerate (-)-bornyl isovalerate isobornyl isovalerate S-sec-butyl thioisovalerate butyl valerate butyl isovalerate isobutyl valerate isobutyl isovalerate carvyl isovalerate cinnamyl valerate cinnamyl isovalerate citronellyl valerate citronellyl isovalerate para-cresyl valerate para-cresyl isovalerate cyclohexyl valerate cyclohexyl isovalerate cyclotene isovalerate decyl valerate decyl isovalerate ethyl valerate ethyl isovalerate eugenyl isovalerate furfuryl isovalerate furfuryl valerate geranyl valerate geranyl isovalerate (E)-2-hepten-1-yl isovalerate heptyl isovalerate sec-heptyl isovalerate (E)-2-hexen-1-yl valerate (E)-2-hexen-1-yl isovalerate (Z)-3-hexen-1-yl valerate (Z)-3-hexen-1-yl isovalerate hexyl valerate hexyl isovalerate linalyl valerate linalyl isovalerate menthyl valerate menthyl isovalerate methyl 2-methyl valerate methyl 4-methyl valerate 2-methyl butyl isovalerate 4-methyl pentyl isovalerate methyl thio isovalerate methyl valerate methyl isovalerate myrtenyl isovalerate neryl isovalerate nonyl isovalerate nonyl valerate octyl valerate octyl isovalerate phenethyl isovalerate 2-phenethyl valerate 3-phenyl propyl isovalerate phenyl propyl valerate S-prenyl thioisovalerate isopropyl thioisovalerate propyl valerate propyl isovalerate isopropyl valerate isopropyl isovalerate rhodinyl isovalerate terpinyl isovalerate terpinyl valerate   Organoleptic Properties: Odor Type: fruity fruity apple green apple Odor Description:at 100.00 %. fruity Odor and/or flavor descriptions from others (if found).   Cosmetic Information: None found   Suppliers: Grau Aromatics HEPTYL-VALERATE NI, Kosher SRS Aromatics HEPTYL VALERATE Synerzine heptyl isovalerate   Safety Information:   Hazards identification   Classification of the substance or mixture GHS Classification in accordance with 29 CFR 1910 (OSHA HCS) None found. GHS Label elements, including precautionary statements   Pictogram   Hazard statement(s) None found. Precautionary statement(s) None found. Oral/Parenteral Toxicity: Not determined Dermal Toxicity: Not determined Inhalation Toxicity: Not determined   Safety in Use Information: Category: fragrance agents RIFM Fragrance Material Safety Assessment: Search IFRA Code of Practice Notification of the 49th Amendment to the IFRA Code of Practice Recommendation for heptyl valerate usage levels up to:   6.0000 % in the fragrance concentrate.   Recommendation for heptyl valerate flavor usage levels up to:   not for flavor use.   Safety References: EPI System: View AIDS Citations:Search Cancer Citations:Search Toxicology Citations:Search EPA Substance Registry Services (TSCA):5451-80-9 EPA ACToR:Toxicology Data EPA Substance Registry Services (SRS):Registry Laboratory Chemical Safety Summary :79544 National Institute of Allergy and Infectious Diseases:Data heptyl pentanoate Chemidplus:0005451809   References:   heptyl pentanoate NIST Chemistry WebBook: Search Inchi Pubchem (cid): 79544 Pubchem (sid): 135037380 Pherobase: View   Other Information: (IUPAC): Atomic Weights of the Elements 2011 (pdf) Videos: The Periodic Table of Videos tgsc: Atomic Weights use for this web site (IUPAC): Periodic Table of the Elements HMDB (The Human Metabolome Database): Search Export Tariff Code: 2915.60.0000 VCF-Online: VCF Volatile Compounds in Food ChemSpider: View   Potential Blenders and core components note For Odor animal methyl (E)-2-octenoate FL/FR balsamic iso amyl benzoate FL/FR fir carboxylate FR hexyl cinnamate FR citrus (R)- citronellyl nitrile FR citrus specialty FR 2- heptanol FL/FR ethereal cyclohexyl formate FL/FR fatty 3- decen-2-one FL/FR hexyl pivalate FR methyl (E)-2-hexenoate FL/FR methyl 2-hexenoate FL/FR floral alpha- amyl cinnamaldehyde diethyl acetal FR boronia absolute FL/FR cassis cyclohexene FR citronellyl valerate FL/FR gamma- damascone FR dihydrocarvyl acetate FL/FR (±)-2,3- dihydrofarnesol FL/FR 6,8- dimethyl-2-nonanol FR (E)- geranyl acetone FL/FR geranyl formate FL/FR geranyl isobutyrate FL/FR hexyl lactate FL/FR hexyl nonanoate FL/FR jasmin cyclopentanol FR (Z)- jasmone FL/FR (2- methoxy-1-methyl propyl) benzene FR para- methyl benzyl acetate FL/FR papaya isobutyrate FL/FR tilia cordata flower oil CO2 extract FR fruity allyl amyl glycolate FR allyl butyrate FL/FR 3- allyl oxy-1,4-dimethyl bicyclo(3.2.1)octane FR iso amyl butyrate FL/FR iso amyl valerate FL/FR apple ketal FL/FR 3- butyl bicyclo[3.2.1]-6-octen-2-one FR iso butyl octanoate FL/FR iso butyl propionate FL/FR cherry pentenoate FL/FR cinnamyl hexanoate FL/FR 2- cyclopentyl cyclopentanone FL/FR 1,4- dibutyl-6,8-dioxabicyclo(3.2.1)octane FR diethyl malonate FL/FR dimethyl succinate FL/FR ethyl (E)-3-hexenoate FL/FR ethyl 2-cyclohexyl propionate FR ethyl 2-hexenoate FL/FR ethyl 2-methyl butyrate FL/FR ethyl 2-octenoate FL/FR ethyl acetoacetate FL/FR ethyl bicyclo(2.2.1)-5-heptene-2-carboxylate FL/FR endo- ethyl bicyclo(2.2.1)-5-heptene-2-carboxylate FR ethyl levulinate FL/FR ethyl methyl-para-tolyl glycidate FL/FR (E,E)- ethyl sorbate FL/FR fig crotonate FR fruity butanate FR geranyl ethyl ether FL/FR geranyl isovalerate FL/FR 2- heptyl butyrate FL/FR heptyl isobutyrate FL/FR 2- hexen-1-ol FL/FR (E)-3- hexen-1-yl acetate FL/FR (Z)-3- hexen-1-yl anthranilate FL/FR (Z)-3- hexen-1-yl isobutyrate FL/FR hexyl (E)-tiglate FL/FR hexyl acetate FL/FR hexyl isovalerate FL/FR hexyl propionate FL/FR hexyl valerate FL/FR methyl 2-methyl butyrate FL/FR methyl heptanoate FL/FR methyl octadienoate FL/FR methyl valerate FL/FR 3- methyl-2-butenal FL/FR nerolidyl isobutyrate FR (Z)-6- nonenal dimethyl acetal FR octen-1-yl cyclopentanone FL/FR octyl butyrate FL/FR 2- pentyl furan FL/FR 3- phenyl propyl hexanoate FL/FR 4- phenyl-2-butyl acetate FL/FR pineapple pentenoate FL/FR prenyl hexanoate FL/FR rhubarb undecane FR (E,E)- sorbyl butyrate FL/FR sorbyl butyrate FL/FR tetrahydrofurfuryl butyrate FL/FR tropical specialty FR tropical thiazole FL/FR tropical trithiane FL/FR green acetaldehyde benzyl 2-methoxyethyl acetal FL/FR actinidia chinensis fruit extract FL/FR actinidia chinensis fruit water FR allyl phenethyl ether FR black currant bud absolute replacer FL/FR alpha- decalactone FL/FR ethyl (E)-2-decenoate FL/FR ethyl (E)-2-hexenoate FL/FR ethyl (E)-4-decenoate FL/FR galbanum specialty FR green dioxolane FR green note propionate FL/FR herbal cyclohexane FR hexanal dimethyl acetal FL/FR (Z)-3- hexen-1-yl (E)-2-hexenoate FL/FR (Z)-3- hexen-1-yl 2-methyl butyrate FL/FR (Z)-3- hexen-1-yl acetate FL/FR (Z)-3- hexen-1-yl hexanoate FL/FR (Z)-3- hexen-1-yl isovalerate FL/FR (E)-2- hexen-1-yl propionate FL/FR (E)-2- hexen-1-yl valerate FL/FR (Z)-3- hexen-1-yl valerate FL/FR (E)-2- hexenal propylene glycol acetal FL/FR 3- hexenyl acetate FL/FR (Z)-3- hexenyl methyl ether FR hexyl isobutyrate FL/FR hexyl octanoate FL/FR manzanate (Givaudan) FL/FR methyl (E)-3-hexenoate FL/FR neogall FR (E)-2- pentenal FL/FR 2- pentenal FL/FR propylene acetal FL/FR sorbyl isobutyrate FL/FR (E,E)- sorbyl isobutyrate FL/FR 1-[(3aS,7aR)-3a,4,7,7a- tetrahydro-1H-inden-6-yl]ethanone FR thiogeraniol FL/FR violet dienyne FR herbal 6- methoxy-2,6-dimethyl octanal FR (1S,5R)- myrtenyl acetate FL/FR 2- pentyl acetate FL/FR tagete oil india FL/FR tricyclodecyl acetate FR viridiflorol FL/FR minty carvyl acetate FL/FR spicy cinnamyl isovalerate FL/FR cinnamyl propionate FL/FR 2,5- dimethyl bicyclo(3.2.1)-2-octen-3-yl acetate + 1,4-dimethyl bicyclo(3.2.1)-2-octen-3-yl acetate FR sulfurous 4- methyl 4-mercaptopentan-2-one 1% solution FL/FR waxy (E)- methyl geranate FL/FR octyl 2-methyl butyrate FL/FR winey methyl 3-acetoxyoctanoate FL/FR woody lariciu pine needle oil FR verdoxan FR For Flavor No flavor group found for these acetaldehyde benzyl 2-methoxyethyl acetal FL/FR iso butyl octanoate FL/FR cinnamyl hexanoate FL/FR citronellyl valerate FL/FR 2- cyclopentyl cyclopentanone FL/FR alpha- decalactone FL/FR ethyl 2-hexenoate FL/FR ethyl bicyclo(2.2.1)-5-heptene-2-carboxylate FL/FR geranyl ethyl ether FL/FR 2- heptyl butyrate FL/FR hexanal dimethyl acetal FL/FR (E)-2- hexenal propylene glycol acetal FL/FR 3- hexenyl acetate FL/FR hexyl nonanoate FL/FR hexyl propionate FL/FR hexyl valerate FL/FR methyl (E)-2-hexenoate FL/FR methyl 2-hexenoate FL/FR methyl 3-acetoxyoctanoate FL/FR 4- methyl 4-mercaptopentan-2-one 1% solution FL/FR (E)- methyl geranate FL/FR methyl octadienoate FL/FR 2- pentenal FL/FR 4- phenyl-2-butyl acetate FL/FR prenyl hexanoate FL/FR propylene acetal FL/FR (E,E)- sorbyl butyrate FL/FR (E,E)- sorbyl isobutyrate FL/FR viridiflorol FL/FR sorbyl isobutyrate FL/FR alliaceous alliaceous tropical thiazole FL/FR berry heptyl isobutyrate FL/FR cooling manzanate (Givaudan) FL/FR dairy 2- pentyl acetate FL/FR estery ethyl acetoacetate FL/FR fatty ethyl (E)-4-decenoate FL/FR floral cinnamyl propionate FL/FR dihydrocarvyl acetate FL/FR (±)-2,3- dihydrofarnesol FL/FR (E)- geranyl acetone FL/FR geranyl isobutyrate FL/FR (Z)-3- hexen-1-yl anthranilate FL/FR fruity iso amyl benzoate FL/FR iso amyl valerate FL/FR apple ketal FL/FR boronia absolute FL/FR iso butyl propionate FL/FR cherry pentenoate FL/FR cinnamyl isovalerate FL/FR black currant bud absolute replacer FL/FR diethyl malonate FL/FR dimethyl succinate FL/FR ethyl (E)-2-decenoate FL/FR ethyl (E)-2-hexenoate FL/FR ethyl (E)-3-hexenoate FL/FR ethyl 2-methyl butyrate FL/FR ethyl 2-octenoate FL/FR ethyl levulinate FL/FR ethyl methyl-para-tolyl glycidate FL/FR (E,E)- ethyl sorbate FL/FR 2- heptanol FL/FR 2- hexen-1-ol FL/FR (Z)-3- hexen-1-yl (E)-2-hexenoate FL/FR (E)-3- hexen-1-yl acetate FL/FR (Z)-3- hexen-1-yl isobutyrate FL/FR hexyl acetate FL/FR hexyl lactate FL/FR methyl (E)-2-octenoate FL/FR methyl 2-methyl butyrate FL/FR para- methyl benzyl acetate FL/FR methyl heptanoate FL/FR methyl valerate FL/FR 3- methyl-2-butenal FL/FR octen-1-yl cyclopentanone FL/FR 3- phenyl propyl hexanoate FL/FR pineapple pentenoate FL/FR sorbyl butyrate FL/FR tetrahydrofurfuryl butyrate FL/FR tropical trithiane FL/FR green actinidia chinensis fruit extract FL/FR allyl butyrate FL/FR cyclohexyl formate FL/FR 3- decen-2-one FL/FR geranyl formate FL/FR geranyl isovalerate FL/FR green note propionate FL/FR (Z)-3- hexen-1-yl 2-methyl butyrate FL/FR (Z)-3- hexen-1-yl acetate FL/FR (Z)-3- hexen-1-yl hexanoate FL/FR (Z)-3- hexen-1-yl isovalerate FL/FR (E)-2- hexen-1-yl propionate FL/FR (Z)-3- hexen-1-yl valerate FL/FR (E)-2- hexen-1-yl valerate FL/FR hexyl (E)-tiglate FL/FR hexyl isobutyrate FL/FR hexyl isovalerate FL/FR hexyl octanoate FL/FR methyl (E)-3-hexenoate FL/FR papaya isobutyrate FL/FR (E)-2- pentenal FL/FR 2- pentyl furan FL/FR thiogeraniol FL/FR herbal tagete oil india FL/FR minty carvyl acetate FL/FR waxy iso amyl butyrate FL/FR octyl 2-methyl butyrate FL/FR octyl butyrate FL/FR woody (Z)- jasmone FL/FR (1S,5R)- myrtenyl acetate FL/FR   Potential Uses: FR fruit   Occurrence (nature, food, other):note   chile pepper Search Trop Picture   heracleum dissectum Search Trop Picture   pepper bonnet pepper Search Trop Picture   Synonyms:   heptyl pentanoate   heptyl-valerate   pentanoic acid heptyl ester   pentanoic acid, heptyl ester   valeric acid heptyl ester   valeric acid, heptyl ester   Articles:   None found yet. 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Notes: None found