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121-00-6

121-00-6 Structure

121-00-6 Structure
IdentificationMore
[Name]

3-TERT-BUTYL-4-HYDROXYANISOLE
[CAS]

121-00-6
[Synonyms]

2-TERT-BUTYL-4-METHOXYPHENOL
3-BHA
3-T-BUTYL-4-HYDROXYANISOLE
3-TERT-BUTYL-4-HYDROXYANISOLE
4-HYDROXY-3-TERT-BUTYLANISOLE
AKOS BBS-00008117
AURORA 4808
BHA
BUTYLATED HYDROXYANISOLE
BUTYL HYDROXY ANISOLE
TERT-BUTYL HYDROXYANISOLE
2-(1,1-dimethylethyl)-4-methoxy-pheno
2-(1,1-Dimethylethyl)-4-methoxyphenol
2-(1,1-dimethylethyl)-4-methoxy-Phenol
2-1,1-Dimethylethyl-4-methoxyphenol
2-t-Butyl-4-methoxyphenol
2-tert-
2-tert-Bha
2-tert-butyl-4
2-tert-butyl-4-methoxy-pheno
[EINECS(EC#)]

204-442-7
[Molecular Formula]

C11H16O2
[MDL Number]

MFCD00040484
[Molecular Weight]

180.24
[MOL File]

121-00-6.mol
Chemical PropertiesBack Directory
[Melting point ]

58-64 °C
[Boiling point ]

269℃
[density ]

1.009
[vapor pressure ]

1.33 hPa (105 °C)
[refractive index ]

1.4708 (estimate)
[Fp ]

110 °C
[storage temp. ]

0-6°C
[solubility ]

ethanol: soluble1g/10 mL, clear, colorless to faint yellow or tan
[form ]

Powder/Waxy Solid
[pka]

11.83±0.18(Predicted)
[color ]

White to off-white
[Water Solubility ]

610-3400mg/L at 27-29℃
[BRN ]

1867499
[LogP]

1-2.82 at 25-27℃
[CAS DataBase Reference]

121-00-6(CAS DataBase Reference)
[EPA Substance Registry System]

Phenol, 2-(1,1-dimethylethyl)-4-methoxy- (121-00-6)
Safety DataBack Directory
[Risk Statements ]

R36/37/38:Irritating to eyes, respiratory system and skin .
[Safety Statements ]

S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection .
[RIDADR ]

3077
[WGK Germany ]

2
[RTECS ]

SK1575000
[HazardClass ]

9
[PackingGroup ]

III
[HS Code ]

2909500000
[Hazardous Substances Data]

121-00-6(Hazardous Substances Data)
[Toxicity]

LD50 orally in Rabbit: 880 mg/kg
Hazard InformationBack Directory
[Uses]

An antioxidant stabilizer of fats that has shown carcinogenicity at high doses
[Uses]

antioxidant in foods (beverages, gum, ice cream, fruits, cereals), cosmetics, topical medications, animal feeds, petroleum products, jet fuels, rubber, plastics, paints, glues.
[Definition]

ChEBI: 3-tert-butyl-4-hydroxyanisole is an aromatic ether that is 4-methoxyphenol in which one of the hydrogens ortho- to the phenolic hydroxy group is replaced by a tert-butyl group. It has a role as an antioxidant and a human xenobiotic metabolite. It is a member of phenols and an aromatic ether.
[General Description]

Pharmaceutical secondary standards for application in quality control, provide pharma laboratories and manufacturers with a convenient and cost-effective alternative to the preparation of in-house working standards.
3-tert-Butyl-4-hydroxyanisole is a synthetic antioxidant, widely used as a food additive to prevent oxidative deterioration of fats and oils.
[Flammability and Explosibility]

Nonflammable
[Purification Methods]

Fractionally distil the phenol in vacuo, then pass it as a solution in CHCl3 through alumina, and evaporate the eluate. Recrystallise the residue from pet ether. [Beilstein 6 IV 6013.]
Spectrum DetailBack Directory
[Spectrum Detail]

3-TERT-BUTYL-4-HYDROXYANISOLE(121-00-6)MS
3-TERT-BUTYL-4-HYDROXYANISOLE(121-00-6)1HNMR
3-TERT-BUTYL-4-HYDROXYANISOLE(121-00-6)13CNMR
3-TERT-BUTYL-4-HYDROXYANISOLE(121-00-6)IR1
3-TERT-BUTYL-4-HYDROXYANISOLE(121-00-6)IR2
3-TERT-BUTYL-4-HYDROXYANISOLE(121-00-6)Raman
Well-known Reagent Company Product InformationBack Directory
[Sigma Aldrich]

121-00-6(sigmaaldrich)
[TCI AMERICA]

4-Hydroxy-3-tert-butylanisole,>98.0%(GC)(121-00-6)
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