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W391808

Sigma-Aldrich

4-tert-Butylphenol

≥99%, FG

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About This Item

Linear Formula:
(CH3)3CC6H4OH
CAS Number:
98-54-4
Molecular Weight:
150.22
FEMA Number:
3918
Beilstein:
1817334
EC Number:
202-679-0
MDL number:
MFCD00002367
UNSPSC Code:
12164502
PubChem Substance ID:
24901936
Flavis number:
4.064

biological source

synthetic

grade

FG

reg. compliance

EU Regulation 1334/2008 & 872/2012

vapor pressure

1 mmHg ( 70 °C)

Assay

≥99%

bp

236-238 °C (lit.)

mp

96-101 °C (lit.)

solubility

ethanol: 50 mg/mL, clear, colorless

density

0.908 g/mL at 25 °C (lit.)

application(s)

flavors and fragrances

Documentation

see Safety & Documentation for available documents

food allergen

no known allergens

Organoleptic

leather

SMILES string

CC(C)(C)c1ccc(O)cc1

InChI

1S/C10H14O/c1-10(2,3)8-4-6-9(11)7-5-8/h4-7,11H,1-3H3

InChI key

QHPQWRBYOIRBIT-UHFFFAOYSA-N

Gene Information

mouse ... Esr1(13982)
rat ... Ar(24208)

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General description

4-tert-Butylphenol is an alkylphenolic compound that can be used as a flavoring agent. It is also a component of adhesives and polymers used for food packaging.

Signal Word

Danger

Hazard Statements

H315,H318,H361f,H410

Hazard Classifications

Aquatic Chronic 1 - Eye Dam. 1 - Repr. 2 - Skin Irrit. 2

Storage Class Code

13 - Non Combustible Solids

WGK

WGK 3

Flash Point(F)

235.4 °F - closed cup

Flash Point(C)

113 °C - closed cup

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

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Certificates of Analysis (COA)

Lot/Batch Number
STBG1071V
STBG0045V
STBF5518V
STBF2509V
STBF3975V

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