butylated xylenol, 1879-09-0

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CODE151678 CODE151678
Product(s):
1879-09-0 2-tert-Butyl-4,6-dimethylphenol 95%

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CODE151678 CODE151678
Product(s):
B0903 6-tert-Butyl-2,4-xylenol >97.0%(GC)
SDS

Name:	2-tert-butyl-4,6-dimethylphenol
CAS Number:	1879-09-0	3D/inchi
Other(deleted CASRN):	72847-40-6
ECHA EINECS - REACH Pre-Reg:	217-533-1
FDA UNII:	4HZG7U1P1S
Nikkaji Web:	J150.062G
Beilstein Number:	1941702
XlogP3-AA:	4.00 (est)
Molecular Weight:	178.27466000
Formula:	C12 H18 O
BioActivity Summary:	listing
NMR Predictor:	Predict (works with chrome, Edge or firefox)

Category:antioxidants

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
Google Patents:	Search
US Patents:	Search
EU Patents:	Search
Pubchem Patents:	Search
PubMed:	Search
NCBI:	Search

Physical Properties:

Appearance:	yellow liquid (est)
Assay:	95.00 to 100.00
Food Chemicals Codex Listed:	No
Melting Point:	22.30 °C. @ 760.00 mm Hg
Boiling Point:	249.00 °C. @ 760.00 mm Hg
Flash Point:	228.00 °F. TCC ( 108.90 °C. ) (est)
logP (o/w):	4.090 (est)
Soluble in:
	water, 29.64 mg/L @ 25 °C (est)

Organoleptic Properties:

Odor and/or flavor descriptions from others (if found).

Cosmetic Information:

CosIng:	cosmetic data
Cosmetic Uses:	antioxidants

Suppliers:

BOC Sciences

For experimental / research use only.

2-tert-Butyl-4,6-dimethylphenol 95%

Santa Cruz Biotechnology

For experimental / research use only.

2-tert-butyl-4,6-dimethylphenol

TCI AMERICA

For experimental / research use only.

6-tert-Butyl-2,4-xylenol >97.0%(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-guinea pig LDLo 420 mg/kg BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD LUNGS, THORAX, OR RESPIRATION: OTHER CHANGES LUNGS, THORAX, OR RESPIRATION: ACUTE PULMONARY EDEMA Journal of the American Pharmaceutical Association, Scientific Edition. Vol. 38, Pg. 366, 1949. oral-mouse LD50 530 mg/kg GASTROINTESTINAL: ULCERATION OR BLEEDING FROM SMALL INTESTINE LUNGS, THORAX, OR RESPIRATION: ACUTE PULMONARY EDEMA Journal of the American Pharmaceutical Association, Scientific Edition. Vol. 38, Pg. 366, 1949. oral-rabbit LDLo 55 mg/kg LUNGS, THORAX, OR RESPIRATION: OTHER CHANGES LUNGS, THORAX, OR RESPIRATION: ACUTE PULMONARY EDEMA BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD Journal of the American Pharmaceutical Association, Scientific Edition. Vol. 38, Pg. 366, 1949. oral-rat LDLo 1400 mg/kg Journal of the American Pharmaceutical Association, Scientific Edition. Vol. 38, Pg. 366, 1949.
Dermal Toxicity:
skin-guinea pig LDLo 7100 mg/kg LUNGS, THORAX, OR RESPIRATION: OTHER CHANGES LUNGS, THORAX, OR RESPIRATION: ACUTE PULMONARY EDEMA BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD Journal of the American Pharmaceutical Association, Scientific Edition. Vol. 38, Pg. 366, 1949. skin-rabbit LDLo 17 mg/kg LUNGS, THORAX, OR RESPIRATION: DYSPNEA BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD BEHAVIORAL: MUSCLE WEAKNESS National Technical Information Service. Vol. OTS0555501
Inhalation Toxicity:
Not determined

Safety in Use Information:

Category:
antioxidants
Recommendation for butylated xylenol usage levels up to:
	not for fragrance use.

Recommendation for butylated xylenol 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):1879-09-0

EPA ACToR:Toxicology Data

EPA Substance Registry Services (SRS):Registry

Laboratory Chemical Safety Summary :15884

National Institute of Allergy and Infectious Diseases:Data

2-tert-butyl-4,6-dimethylphenol

Chemidplus:0001879090

EPA/NOAA CAMEO:hazardous materials

RTECS:ZE6825000 for cas# 1879-09-0

References:

	2-tert-butyl-4,6-dimethylphenol
NIST Chemistry WebBook:	Search Inchi
Canada Domestic Sub. List:	1879-09-0
Pubchem (cid):	15884
Pubchem (sid):	134979073

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:	2907.19.8000
ChemSpider:	View
Wikipedia:	View

Potential Blenders and core components note

None Found

Potential Uses:

None Found

Occurrence (nature, food, other):note

not found in nature

Synonyms:

6-t-	butyl-2,4-dimethylphenol
6-tert-	butyl-2,4-dimethylphenol
6-t-	butyl-2,4-xylenol
6-tert-	butyl-2,4-xylenol
2-tert-	butyl-4,6-dimethylphenol
2,4-	dimethyl-6-tert-butylphenol
	phenol, 2-(1,1-dimethylethyl)-4,6-dimethyl-
	prodox 340
	topanol A
2,4-	xylenol, 6-tert-butyl-

Articles:

PubMed:Antioxidant activity of propofol and related monomeric and dimeric compounds.

PubMed:Measurement of plasma hydroperoxide concentration by FOX-1 assay in conjunction with triphenylphosphine.

PubMed:Reversed-phase HPLC of polymer additives with multiple on-line spectroscopic analysis (UV, IR, (1)H NMR and MS).

PubMed:Lipid hydroperoxide determination in dark chicken meat through a ferrous oxidation-xylenol orange method.

PubMed:Re-evaluation of the ferrous oxidation in xylenol orange assay for the measurement of plasma lipid hydroperoxides.

PubMed:Peroxide accumulation in detergents.

PubMed:Determination of topanol antioxidants in methacrylates using capillary gas-liquid chromatography.

PubMed:Pharmacologic and genetic studies on the modulatory effects of butylated hydroxytoluene on mouse lung adenoma formation.

Notes:

None found

butylated xylenol phenol, 2-(1,1-dimethylethyl)-4,6-dimethyl-

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Articles:

butylated xylenol
phenol, 2-(1,1-dimethylethyl)-4,6-dimethyl-