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1160923-92-1 | 3-Pyridinecarbonitrile, 4-chloro-5-ethenyl-
CAS No: 1160923-92-1 Catalog No: AG000BLZ MDL No:
Product Description
Catalog Number:
AG000BLZ
Chemical Name:
3-Pyridinecarbonitrile, 4-chloro-5-ethenyl-
CAS Number:
1160923-92-1
Molecular Formula:
C8H5ClN2
Molecular Weight:
164.5917
IUPAC Name:
4-chloro-5-ethenylpyridine-3-carbonitrile
InChI:
InChI=1S/C8H5ClN2/c1-2-6-4-11-5-7(3-10)8(6)9/h2,4-5H,1H2
InChI Key:
IAOCPQXAWJXUKZ-UHFFFAOYSA-N
SMILES:
C=Cc1cncc(c1Cl)C#N
Properties
Complexity:
194
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
164.014g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
164.592g/mol
Monoisotopic Mass:
164.014g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
36.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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