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137993-38-5 | Benzeneacetonitrile, 3-fluoro-α-hydroxy-, (αR)-
CAS No: 137993-38-5 Catalog No: AG0017SH MDL No:
Product Description
Catalog Number:
AG0017SH
Chemical Name:
Benzeneacetonitrile, 3-fluoro-α-hydroxy-, (αR)-
CAS Number:
137993-38-5
Molecular Formula:
C8H6FNO
Molecular Weight:
151.1377
IUPAC Name:
(2R)-2-(3-fluorophenyl)-2-hydroxyacetonitrile
InChI:
InChI=1S/C8H6FNO/c9-7-3-1-2-6(4-7)8(11)5-10/h1-4,8,11H/t8-/m0/s1
InChI Key:
PIUFDVZAZWZBCK-QMMMGPOBSA-N
SMILES:
N#C[C@@H](c1cccc(c1)F)O
Properties
Complexity:
174
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
151.043g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
151.14g/mol
Monoisotopic Mass:
151.043g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
44A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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