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1006376-60-8 | Benzenemethanol, α-(chloromethyl)-3,4-difluoro-, (αS)-
CAS No: 1006376-60-8 Catalog No: AG0002J3 MDL No:MFCD09863590
Product Description
Catalog Number:
AG0002J3
Chemical Name:
Benzenemethanol, α-(chloromethyl)-3,4-difluoro-, (αS)-
CAS Number:
1006376-60-8
Molecular Formula:
C8H7ClF2O
Molecular Weight:
192.5904
MDL Number:
MFCD09863590
IUPAC Name:
(1S)-2-chloro-1-(3,4-difluorophenyl)ethanol
InChI:
InChI=1S/C8H7ClF2O/c9-4-8(12)5-1-2-6(10)7(11)3-5/h1-3,8,12H,4H2/t8-/m1/s1
InChI Key:
RYOLLNVCYSUXCP-MRVPVSSYSA-N
SMILES:
ClC[C@H](c1ccc(c(c1)F)F)O
EC Number:
819-945-2
Properties
Complexity:
145
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
192.015g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
192.59g/mol
Monoisotopic Mass:
192.015g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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