ChemicalBook--->CAS DataBase List--->1006376-60-8

1006376-60-8

1006376-60-8 Structure

1006376-60-8 Structure
IdentificationBack Directory
[Name]

(1S)-2-chloro-1-(3,4-difluorophenyl)-1-ethanol
[CAS]

1006376-60-8
[Synonyms]

(ALPHAS)-ALPHA
Tigrelo Impurity 45
(1S)-2-chloro-1-(3,4-difluorophenyl)-1-ethanol
(1S)-2-Chloro-1-(3,4-difluorophenyl)ethan-1-ol
Benzenemethanol, α-(chloromethyl)-3,4-difluoro-
Benzenemethanol, α-(chloromethyl)-3,4-difluoro-, (αS)-
(alphaS)-alpha-(Chloromethyl)-3,4-difluorobenzenemethanol
[Molecular Formula]

C8H7ClF2O
[MDL Number]

MFCD09863590
[MOL File]

1006376-60-8.mol
[Molecular Weight]

192.59
Chemical PropertiesBack Directory
[Boiling point ]

256.3±35.0 °C(Predicted)
[density ]

1.372±0.06 g/cm3(Predicted)
[storage temp. ]

Sealed in dry,2-8°C
[solubility ]

Chloroform (Slightly), Methanol (Slightly)
[form ]

viscous liquid
[pka]

12.49±0.20(Predicted)
[color ]

Clear, almost colourless
[Optical Rotation]

Consistent with structure
[InChI]

InChI=1/C8H7ClF2O/c9-4-8(12)5-1-2-6(10)7(11)3-5/h1-3,8,12H,4H2/t8-/s3
[InChIKey]

RYOLLNVCYSUXCP-SBYBRXNCNA-N
[SMILES]

[C@@H](C1=CC=C(F)C(F)=C1)(O)CCl |&1:0,r|
Safety DataBack Directory
[Symbol(GHS) ]

Skull and Crossbones (GHS06)Health Hazard (GHS08)
GHS06,GHS08
[Signal word ]

Danger
[Hazard statements ]

H301-H315-H317-H319-H334-H335
[Precautionary statements ]

P261-P280-P301+P310-P305+P351+P338-P342+P311
[REACH Registrations]

Active
[HS Code ]

2906290090
Hazard InformationBack Directory
[Uses]

(S)-2-Chloro-1-(3,4-difluorophenyl)ethanol is a building block used in organic synthesis including bein an intermediate in the synthesis of Ticagrelor (T437700), the first reversible oral P2Y12 receptor antagonist, provides faster, greater, and more consistent ADP-receptor inhibition than Clopidogrel.
Spectrum DetailBack Directory
[Spectrum Detail]

(1S)-2-chloro-1-(3,4-difluorophenyl)-1-ethanol(1006376-60-8)FT-IR
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