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685852

(S)-4-Fluoro-α-methylbenzyl alcohol

97%

Synonym(s):

(S)-1-(4′-Fluorophenyl)ethanol

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About This Item

Linear Formula:
FC6H4CH(CH3)OH
CAS Number:
101219-73-2
Molecular Weight:
140.15
NACRES:
NA.22
PubChem Substance ID:
329761004
UNSPSC Code:
12352101
MDL number:
MFCD03092998
Assay:
97%
Form:
liquid
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assay

97%

form

liquid

optical activity

[α]20/D -49.0°, c = 1 in chloroform

reaction suitability

reagent type: chrial catalyst

refractive index

n20/D 1.502

density

1.111 g/mL at 25 °C

functional group

fluoro, hydroxyl

SMILES string

C[C@H](O)c1ccc(F)cc1

InChI

1S/C8H9FO/c1-6(10)7-2-4-8(9)5-3-7/h2-6,10H,1H3/t6-/m0/s1

InChI key

PSDSORRYQPTKSV-LURJTMIESA-N

Application

(S)-4-Fluoro-α-methylbenzyl alcohol can be used as a starting material to synthesize a CCR5 antagonist named MLN1251.Along with its ortho- and non-fluorine substituted analogs, it can be used to study the role of fluorine substitution in chiral discrimination in molecular complexes.

Pictograms

Exclamation mark
GHS07

Signal Word

Warning

Hazard Classifications

Acute Tox. 4 Oral - Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3

Target Organs

Respiratory system

Storage Class

10 - Combustible liquids

Flash Point (°F)

Not applicable

Flash Point (°C)

Not applicable

PPE (personal protective equipment)

Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter

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