2-cyclohexyl cyclohexanone
bicyclohexanone P (IFF)

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  Product(s):
  C0612 2-Cyclohexylcyclohexanone >95.0%(GC)
  SDS

Name: 2-cyclohexylcyclohexan-1-one CAS Number: 90-42-6 3D/inchi Other(deleted CASRN): 112684-84-1 ECHA EINECS - REACH Pre-Reg: 201-991-4 FDA UNII: B3QU3533W8 Nikkaji Web: J41.835H Beilstein Number: 1865785 MDL: MFCD00013795 XlogP: 3.70 (est) Molecular Weight: 180.29060000 Formula: C12 H20 O 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 to solid (est) Assay: 95.00 to 100.00 Food Chemicals Codex Listed: No Specific Gravity: 0.97100 to 0.97700 @ 25.00 °C. Pounds per Gallon - (est).: 8.080 to 8.130 Refractive Index: 1.48500 to 1.49000 @ 20.00 °C. Melting Point: -32.00 °C. @ 760.00 mm Hg Boiling Point: 264.00 to 265.00 °C. @ 760.00 mm Hg Acid Value: 5.00 max. KOH/g Vapor Pressure: 0.010000 mmHg @ 25.00 °C. (est) Flash Point: > 200.00 °F. TCC ( > 93.33 °C. ) logP (o/w): 3.810 Soluble in:   alcohol   water, 30.41 mg/L @ 25 °C (est) Insoluble in:   water   Organoleptic Properties: Odor Type: herbal Odor Strength:medium Substantivity:44 hour(s) at 100.00 % cyclamen sweet herbal cumin minty woody orris ozone Odor Description:at 100.00 %. cyclamen sweet herbal cumin mint woody orris ozone Luebke, William tgsc, (1988) Odor sample from: International Flavors & Fragrances Inc. Odor and/or flavor descriptions from others (if found).   Cosmetic Information: CosIng: cosmetic data Cosmetic Uses: perfuming agents   Suppliers: Santa Cruz Biotechnology For experimental / research use only. 2-Cyclohexylcyclohexanone Sigma-Aldrich: Aldrich For experimental / research use only. 2-Cyclohexylcyclohexanone sds TCI AMERICA For experimental / research use only. 2-Cyclohexylcyclohexanone >95.0%(GC) sds   Safety Information: Preferred SDS: View   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: oral-rat LD50 5000 mg/kg Raw Material Data Handbook, Vol.1: Organic Solvents, 1974. Vol. 1, Pg. 20, 1974. Dermal Toxicity: skin-rabbit LD50 > 7800 mg/kg Raw Material Data Handbook, Vol.1: Organic Solvents, 1974. Vol. 1, Pg. 20, 1974. 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 2-cyclohexyl cyclohexanone usage levels up to:   8.0000 % in the fragrance concentrate.   Recommendation for 2-cyclohexyl cyclohexanone 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):90-42-6 EPA ACToR:Toxicology Data EPA Substance Registry Services (SRS):Registry Laboratory Chemical Safety Summary :7016 National Institute of Allergy and Infectious Diseases:Data WGK Germany:2 2-cyclohexylcyclohexan-1-one Chemidplus:0000090426 RTECS:DT7400000 for cas# 90-42-6   References:   2-cyclohexylcyclohexan-1-one NIST Chemistry WebBook: Search Inchi Canada Domestic Sub. List: 90-42-6 Pubchem (cid): 7016 Pubchem (sid): 134970946   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 CHEMBL: View HMDB (The Human Metabolome Database): Search Export Tariff Code: 2914.29.5000 ChemSpider: View   Potential Blenders and core components note For Odor No odor group found for these satinaldehyde FL/FR (Z)- verbenol FL/FR (E)- verbenol FL/FR aldehydic aldehydic citronellyl oxyacetaldehyde FL/FR geranyl oxyacetaldehyde FR muguet undecadienal FR N/i- tridecanal FR balsamic benzyl salicylate FL/FR iso bornyl formate FL/FR verbenol FL/FR camphoreous herbal ethanone FR citrus (S)-(-)- citronellal FL/FR (Z)-4- decenal FL/FR iso decyl acetate FR marine decadienal FR myrmac aldehyde FR 10- undecen-1-ol FL/FR coconut 3- butyl bicyclo[3.2.1]octan-2-one FR floral citronellyl ethoxalate FR cumin carbinol FR cyclamen aldehyde FL/FR cyclamen homoaldehyde FR cyclamen propanal FR cyclohexyl propanol FR 2- decalinol FR ethyl linalyl acetal FR (E,E)- farnesol FL/FR floral butanal FR floral pyranol FR hawthorn ethanol FR hyacinth acetals FL/FR (E)-beta- ionone FL/FR jasimia FR leerall FR lilyall FR lilyall / methyl anthranilate schiff's base FR magnolia cyclohexanol FR methoxycitronellal FR alpha-iso methyl ionone (50% min.) FL/FR muguet butanal FR muguet butanol FR muguet carboxaldehyde FR muguet ethanol FR muguet nitrile FR muguet propanol FR muguet shiseol FL/FR ocean propanal FL/FR ocean propanal / methyl anthranilate schiff's base FR phenyl glycol diacetate FR rose absolute pentanol FR fresh decyl vinyl ether FR fruity tropical ionone FL/FR green 3,5,6-neo cyclocitral FR fresh nitrile FR green heptenal FR heptanal (aldehyde C-7) FL/FR (Z)-3- hexen-1-yl oxyacetaldehyde FR phenoxyacetaldehyde 50% in benzyl alcohol FR hay para- methyl phenoxyacetaldehyde FR herbal carrot seed oil (daucus carota ssp. gummifer hook. fil.) spain FR carrot seed oil (daucus carota ssp. maximus (desf.) ball) FR daucus carota fruit oil FL/FR (Z)-iso dihydrolavandulyl acetate FR floral nitrile FR iso nonyl acetate FR perillaldehyde FL/FR savin wood oil (juniperus phoenicea) FL/FR common tansy flower oil FR common tansy flower oil dutch FR marine marine carbonitrile FR marine hexane FR marine pyridine FR ocean carboxaldehyde FR ozone propanal FR melon melon heptenal FL/FR minty trans-para- menthan-2-one FL/FR 2,4,4,6- tetramethyl cyclohexa-2,5-diene-1-one FR orris 2(1)- orris butanal FL/FR orris capronate FL/FR powdery dimethyl ionone FR (E)-alpha- methyl ionone (44-50%) FL/FR (E)-alpha- methyl ionone (74-80%) FL/FR thujonic common tansy oil canada FR tropical patchwood FR woody para-tert- butyl cyclohexanone FR woody heptene FR For Flavor No flavor group found for these (S)-(-)- citronellal FL/FR (E,E)- farnesol FL/FR (E)-alpha- methyl ionone (44-50%) FL/FR 2(1)- orris butanal FL/FR savin wood oil (juniperus phoenicea) FL/FR 10- undecen-1-ol FL/FR (Z)- verbenol FL/FR (E)- verbenol FL/FR aromatic aromatic hyacinth acetals FL/FR balsamic benzyl salicylate FL/FR citrus citronellyl oxyacetaldehyde FL/FR (Z)-4- decenal FL/FR floral alpha-iso methyl ionone (50% min.) FL/FR (E)-alpha- methyl ionone (74-80%) FL/FR muguet shiseol FL/FR ocean propanal FL/FR satinaldehyde FL/FR tropical ionone FL/FR green cyclamen aldehyde FL/FR heptanal (aldehyde C-7) FL/FR melon heptenal FL/FR herbal daucus carota fruit oil FL/FR verbenol FL/FR minty trans-para- menthan-2-one FL/FR orris orris capronate FL/FR spicy perillaldehyde FL/FR woody iso bornyl formate FL/FR (E)-beta- ionone FL/FR   Potential Uses:   clean FR floral FR herbal FR lily FR orris   ozone FR woody   Occurrence (nature, food, other):note   not found in nature   Synonyms: 1,1'- bi(cyclohexyl)-2-one   bicyclohexanone P (IFF) (1,1'- bicyclohexyl)-2-one [1,1'- bicyclohexyl]-2-one [1,1'- biphenyl]-2-ol   cyclohexanone, 2-cyclohexyl- 2- cyclohexyl cyclohexan-1-one 2- cyclohexylcyclohexan-1-one   cyclohexylcyclohexanone 2- cyclohexylcyclohexanone o- diphenylol   dorvicide A 2- hydroxybifenyl   lavamenthe 2- phenylcyclohexanone   tumescal 0PE o- xenol o- xonal   Articles:   None found yet. 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Notes: None found