CAS 96-76-4|2,4-Di-t-butylphenol

Introduction:Basic information about CAS 96-76-4|2,4-Di-t-butylphenol, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
Common Name2,4-Di-t-butylphenol
CAS Number96-76-4Molecular Weight206.324
Density0.9±0.1 g/cm3Boiling Point265.5±9.0 °C at 760 mmHg
Molecular FormulaC14H22OMelting Point53-56 °C(lit.)
MSDSChineseUSAFlash Point115.0±0.0 °C
Symbol
GHS07, GHS09
Signal WordWarning

Names

Name2,4-Di-tert-butylphenol
SynonymMore Synonyms

2,4-Di-t-butylphenol BiologicalActivity

Description2,4-Di-tert-butylphenol is an endogenous metabolite.
Related CatalogResearch Areas >>Metabolic Disease
Target

Human Endogenous Metabolite

Chemical & Physical Properties

Density0.9±0.1 g/cm3
Boiling Point265.5±9.0 °C at 760 mmHg
Melting Point53-56 °C(lit.)
Molecular FormulaC14H22O
Molecular Weight206.324
Flash Point115.0±0.0 °C
Exact Mass206.167068
PSA20.23000
LogP4.86
Vapour Pressure0.0±0.6 mmHg at 25°C
Index of Refraction1.499
InChIKeyICKWICRCANNIBI-UHFFFAOYSA-N
SMILESCC(C)(C)c1ccc(O)c(C(C)(C)C)c1
StabilityStable. Combustible. Incompatible with acid chlorides, oxidizing agents, acid anhydrides, copper, copper alloys, bases, brass.
Water Solubilitypractically insoluble

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
SK8260000
CHEMICAL NAME :
Phenol, 2,4-di-tert-butyl-
CAS REGISTRY NUMBER :
96-76-4
BEILSTEIN REFERENCE NO. :
1910383
LAST UPDATED :
199806
DATA ITEMS CITED :
7
MOLECULAR FORMULA :
C14-H22-O
MOLECULAR WEIGHT :
206.36
WISWESSER LINE NOTATION :
1X1&1&R BQ CX1&1&1

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
25 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
NTIS** National Technical Information Service. (Springfield, VA 22161) Formerly U.S. Clearinghouse for Scientific & Technical Information. Volume(issue)/page/year: AD691-490
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
100 mg/kg
TOXIC EFFECTS :
Behavioral - sleep
REFERENCE :
JMCMAR Journal of Medicinal Chemistry. (American Chemical Soc., Distribution Office Dept. 223, POB POB 57136, West End Stn., Washington, DC 20037) V.6- 1963- Volume(issue)/page/year: 23,1350,1980 *** NIOSH STANDARDS DEVELOPMENT AND SURVEILLANCE DATA *** NIOSH OCCUPATIONAL EXPOSURE SURVEY DATA : NOES - National Occupational Exposure Survey (1983) NOES Hazard Code - X9390 No. of Facilities: 309 (estimated) No. of Industries: 7 No. of Occupations: 13 No. of Employees: 7488 (estimated) No. of Female Employees: 25 (estimated)

Safety Information

Symbol
GHS07, GHS09
Signal WordWarning
Hazard StatementsH315-H319-H410
Precautionary StatementsP273-P305 + P351 + P338-P501
Personal Protective Equipmentdust mask type N95 (US);Eyeshields;Gloves
Hazard CodesXn:Harmful;N:Dangerousfortheenvironment;
Risk PhrasesR22;R36/38;R43;R50/53
Safety PhrasesS26-S36/37-S61-S37/39-S29-S24-S45-S36/37/39
RIDADRUN 2430 8/PG 3
WGK Germany2
RTECSSK8260000
Packaging GroupIII
Hazard Class9
HS Code29071900

Customs

HS Code2907199090
Summary2907199090 other monophenols VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:5.5% General tariff:30.0%

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Synonyms

2,4-ditert-butylphenol
2,4-Di-tert-butyl-phenol
phenol, 2,4-di-t-butyl-
2,4-Bis(2-methyl-2-propanyl)phenol
4,6-di-tert-butylphenol
Phenol, 2,4-bis(1,1-dimethylethyl)-
1-Hydroxy-2,4-di-tert-butylbenzene
2,4-Di-t-butylphenol
MFCD00008828
EINECS 202-532-0
2,4-Di-tert-butylphenol
2,4-Bis(1,1-dimethylethyl)phenol
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