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Home > Pyridines > 676563-18-1
676563-18-1 | 2-Pyridinepropanenitrile,beta-hydroxy-,(betaS)-(9CI)
CAS No: 676563-18-1 Catalog No: AG00G1LV MDL No:
Product Description
Catalog Number:
AG00G1LV
Chemical Name:
2-Pyridinepropanenitrile,beta-hydroxy-,(betaS)-(9CI)
CAS Number:
676563-18-1
IUPAC Name:
(3S)-3-hydroxy-3-pyridin-2-ylpropanenitrile
InChI:
InChI=1S/C8H8N2O/c9-5-4-8(11)7-3-1-2-6-10-7/h1-3,6,8,11H,4H2/t8-/m0/s1
InChI Key:
TWNYGRLPYHHNTN-QMMMGPOBSA-N
Properties
Complexity:
161
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
148.064g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
148.165g/mol
Monoisotopic Mass:
148.064g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
56.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.3
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