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1378332-54-7 | 2-Pyrazineacetonitrile, 6-chloro-
CAS No: 1378332-54-7 Catalog No: AG0013WK MDL No:
Product Description
Catalog Number:
AG0013WK
Chemical Name:
2-Pyrazineacetonitrile, 6-chloro-
CAS Number:
1378332-54-7
Molecular Formula:
C6H4ClN3
Molecular Weight:
153.5691
IUPAC Name:
2-(6-chloropyrazin-2-yl)acetonitrile
InChI:
InChI=1S/C6H4ClN3/c7-6-4-9-3-5(10-6)1-2-8/h3-4H,1H2
InChI Key:
LGKGXAIUFDRFQA-UHFFFAOYSA-N
SMILES:
Clc1cncc(n1)CC#N
Properties
Complexity:
150
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
153.009g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
153.569g/mol
Monoisotopic Mass:
153.009g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
49.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3
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