2-tert-Butyl-4-methoxyphenol

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Names

[ CAS No. ]:
121-00-6

[ Name ]:
2-tert-Butyl-4-methoxyphenol

[Synonym ]:
EINECS 204-442-7
2-(1,1-dimethylethyl)-4-(methyloxy)phenol
3-BHA
4-Methoxy-2-(2-methyl-2-propanyl)phenol
2-tert-Butyl-4-methoxyphenol
TERT-BUTYL HYDROXYANISOLE
2-tert-Butyl-4-methoxyphenol,3-BHA,BHA
2-tert-butyl-4
3-tert-butyl-4-hydroxy-anisole
BUTYLATED HYDROXYANISOLE (BHA)
BUTYL HYDROXY ANISOLE
2-tert-Bha
MFCD00040484
4-hydroxy-3-tert-butylanisole
Hydroxybutylanisole
4-Methoxy-6-tert-butylphenol
3-tert-Butyl-4-hydroxyanisole
4-methoxy-2-tert-butylphenol
2-tert
AURORA 4808
2-(tert-Butyl)-4-methoxyphenol
Phenol, 2-(1,1-dimethylethyl)-4-methoxy-
Phenol, (1,1-dimethylethyl)-4-methoxy-
Nipantiox
3-tert-Butyl-p-hydroxyanisole

Chemical & Physical Properties

[ Density]:
1.0±0.1 g/cm3

[ Boiling Point ]:
269.1±28.0 °C at 760 mmHg

[ Melting Point ]:
58-64 °C

[ Molecular Formula ]:
C11H16O2

[ Molecular Weight ]:
180.243

[ Flash Point ]:
105.6±8.9 °C

[ Exact Mass ]:
180.115036

[ PSA ]:
29.46000

[ LogP ]:
3.00

[ Vapour Pressure ]:
0.0±0.6 mmHg at 25°C

[ Index of Refraction ]:
1.508

MSDS

Click to get detail MSDS

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
SK1575000
CHEMICAL NAME :
Phenol, 2-tert-butyl-4-methoxy-
CAS REGISTRY NUMBER :
121-00-6
BEILSTEIN REFERENCE NO. :
1867499
LAST UPDATED :
199710
DATA ITEMS CITED :
10
MOLECULAR FORMULA :
C11-H16-O2
MOLECULAR WEIGHT :
180.27
WISWESSER LINE NOTATION :
1X1&1&R BQ EO1

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
2910 mg/kg
TOXIC EFFECTS :
Gastrointestinal - other changes
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
32 mg/kg
TOXIC EFFECTS :
Gastrointestinal - other changes
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
1583 mg/kg
TOXIC EFFECTS :
Gastrointestinal - other changes
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
29 mg/kg
TOXIC EFFECTS :
Gastrointestinal - other changes
TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - hamster
DOSE/DURATION :
134 gm/kg/24W-C
TOXIC EFFECTS :
Tumorigenic - neoplastic by RTECS criteria Gastrointestinal - tumors
TYPE OF TEST :
TD - Toxic dose (other than lowest)
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - hamster
DOSE/DURATION :
168 gm/kg/20W-C
TOXIC EFFECTS :
Tumorigenic - neoplastic by RTECS criteria Gastrointestinal - tumors

MUTATION DATA

TYPE OF TEST :
Cytogenetic analysis
TEST SYSTEM :
Rodent - hamster Lung
DOSE/DURATION :
125 mg/L
REFERENCE :
MUREAV Mutation Research. (Elsevier Science Pub. B.V., POB 211, 1000 AE Amsterdam, Netherlands) V.1- 1964- Volume(issue)/page/year: 241,125,1990

Safety Information

[ Personal Protective Equipment ]:
Eyeshields;Gloves;type N95 (US);type P1 (EN143) respirator filter

[ Hazard Codes ]:
Xi

[ Risk Phrases ]:
R36/37/38

[ Safety Phrases ]:
S26-S36/37/39

[ RIDADR ]:
NONH for all modes of transport

[ WGK Germany ]:
2

[ RTECS ]:
SK1575000

[ HS Code ]:
2909500000

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • p-tert-butoxyanisole
  • TBMP
  • 2,4-Di-t-butylphenol
  • Mequinol
  • tert-Butanol
  • Hydroquinone
  • 2,4,6-Tri-tert-butylphenol
  • 2-tert-butyl-4-methoxyphenoxyl radical
  • Dimethyl sulfate

DownStream

  • 2-tert-Butyl-1,4-benzoquinone
  • 3-TERT-BUTYL-5-METHOXY-1,2-QUINONE
  • 2',5-ditert-butyl-3,4'-dimethoxyspiro[7-oxabicyclo[4.2.0]octa-1,3,5-triene-8,6'-cyclohexa-2,4-diene]-1'-one
  • 3,3'-di-tert-butylbiphenyldiquinone-(2,5,2',5')
  • 2,4,6-Tri-tert-butylphenol
  • 2-tert-butyl-4-methoxyphenoxyl radical
  • 4,4'-Ethylenebis(2,6-ditert-butylphenol)
  • Butylated hydroxytoluene
  • 2,6-ditert-butyl-4-methylidenecyclohexa-2,5-dien-1-one
  • 3,3',5,5'-Tetra-tert-butyl-4,4'-stilbenequinone

Customs

[ HS Code ]: 2909500000

[ Summary ]:
2909500000 ether-phenols, ether-alcohol-phenols and their halogenated, sulphonated, nitrated or nitrosated derivatives VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:5.5% General tariff:30.0%

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Related Compounds

  • 2-tert-butyl-4-methoxyphenol,phosphorous acid
  • 2-tert-butyl-4-methoxyphenol - 3-tert-butyl-4-methoxyphenol (1:1)
  • 2-tert-butyl-4-methoxyphenol - 3-tert-butyl-4-methoxyphenol (1:1)
  • 2-(tert-Butyl)-4-methoxyphenol-d3
  • 2-tert-butyl-6-hydroperoxy-4-methoxyphenol
  • 2-(tert-butyl)-4,6-bis((dimethylamino)methyl)phenol
  • 2-[4-(aminomethyl)-5-(trifluoromethyl)-1H-1,2,3-triazol-1-yl]-1-cyclopropylethan-1-ol
  • {[1-(2,2-difluoroethyl)-5-(methoxymethyl)-1H-1,2,3-triazol-4-yl]methyl}(methyl)amine
  • {[1-(1-cyclobutylethyl)-5-(methoxymethyl)-1H-1,2,3-triazol-4-yl]methyl}(methyl)amine
  • methyl({[1-(pentan-3-yl)-5-propyl-1H-1,2,3-triazol-4-yl]methyl})amine
  • {[5-ethyl-1-(2-methoxyethyl)-1H-1,2,3-triazol-4-yl]methyl}(methyl)amine
  • [(1-cyclopropyl-5-ethyl-1H-1,2,3-triazol-4-yl)methyl](methyl)amine
  • {[5-ethyl-1-(4-methoxybutan-2-yl)-1H-1,2,3-triazol-4-yl]methyl}(methyl)amine
  • {[5-ethyl-1-(1,1,1-trifluoropropan-2-yl)-1H-1,2,3-triazol-4-yl]methyl}(methyl)amine
  • {[1-(1-cyclobutylethyl)-5-(propan-2-yl)-1H-1,2,3-triazol-4-yl]methyl}(methyl)amine
  • {[1-(2-cyclopropylethyl)-5-(propan-2-yl)-1H-1,2,3-triazol-4-yl]methyl}(methyl)amine
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