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699-02-5

699-02-5 Structure

699-02-5 Structure
IdentificationMore
[Name]

2-(4-METHYLPHENYL)ETHANOL
[CAS]

699-02-5
[Synonyms]

2-(4-METHYLPHENYL)ETHANOL
2-(P-TOLYL)ETHANOL
4-METHYLPHENETHYL ALCOHOL
P-METHYLPHENETHYL ALCOHOL
2-(p-Methylphenyl)ethanol
4-methyl-benzeneethano
4-Methylbenzeneethanol
4-methyl-Benzeneethanol
Phenethyl alcohol, p-methyl-
p-Methylphenylethyl alcohol
[EINECS(EC#)]

211-824-7
[Molecular Formula]

C9H12O
[MDL Number]

MFCD00002904
[Molecular Weight]

136.19
[MOL File]

699-02-5.mol
Chemical PropertiesBack Directory
[Appearance]

Clear colorless to faintly yellow liquid
[Boiling point ]

244-245 °C(lit.)
[density ]

0.978 g/mL at 25 °C(lit.)
[refractive index ]

n20/D 1.526(lit.)
[Fp ]

225 °F
[storage temp. ]

Sealed in dry,Room Temperature
[form ]

clear liquid
[pka]

14.92±0.10(Predicted)
[color ]

Colorless to Light yellow to Light orange
[Specific Gravity]

0.978
[Odor]

at 100.00 %. floral balsamic rose green
[Odor Type]

floral
[InChI]

InChI=1S/C9H12O/c1-8-2-4-9(5-3-8)6-7-10/h2-5,10H,6-7H2,1H3
[InChIKey]

DAVFJRVIVZOKKS-UHFFFAOYSA-N
[SMILES]

C1(CCO)=CC=C(C)C=C1
[LogP]

2.032 (est)
[CAS DataBase Reference]

699-02-5(CAS DataBase Reference)
[EPA Substance Registry System]

Benzeneethanol, 4-methyl- (699-02-5)
Safety DataBack Directory
[Safety Statements ]

S24/25:Avoid contact with skin and eyes .
[WGK Germany ]

3
[TSCA ]

Yes
[HS Code ]

29062990
Hazard InformationBack Directory
[Description]

2-(4-Methylphenyl)ethanol, also known as 4-Methylphenethyl alcohol, 699-02-5, is an oily liquid that can promote bile secretion and protect the liver. It is capable of transporting fat from the liver to the extrahepatic fat pool via the bloodstream and has demonstrated a significant inhibitory effect on liver cell destruction caused by alcoholism.
[Chemical Properties]

Clear colorless to faintly yellow liquid
[Uses]

4-Methylphenethyl alcohol was used in the determination of adducts of 1,2- and 1,4-benzoquinone with cysteine residues of hemoglobin and albumin.
[Preparation]

To prepare 2-(4-Methylphenyl)ethanol, start with 4'-Methylacetophenone as the raw material. Reduce it to 4-methyl-α-phenylethanol using sodium borohydride in ethanol. Mix nicotinic acid with phosphorus oxychloride in pyridine to create nicotinyl chloride. Without separation, add the nicotinyl chloride to the 4-methyl-α-phenylethanol and esterify it into 2-(4-Methylphenyl)ethanol.?
Spectrum DetailBack Directory
[Spectrum Detail]

2-(4-METHYLPHENYL)ETHANOL(699-02-5)MS
2-(4-METHYLPHENYL)ETHANOL(699-02-5)1HNMR
2-(4-METHYLPHENYL)ETHANOL(699-02-5)13CNMR
2-(4-METHYLPHENYL)ETHANOL(699-02-5)IR1
2-(4-METHYLPHENYL)ETHANOL(699-02-5)Raman
Well-known Reagent Company Product InformationBack Directory
[Alfa Aesar]

2-(4-Methylphenyl)ethanol, 99%(699-02-5)
[Sigma Aldrich]

699-02-5(sigmaaldrich)
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