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1000515-40-1

1000515-40-1 | 2-Pyridineacetonitrile, 4-chloro-

CAS No: 1000515-40-1 Catalog No: AG0000P7 MDL No:MFCD09924172

Product Description

Catalog Number:
AG0000P7
Chemical Name:
2-Pyridineacetonitrile, 4-chloro-
CAS Number:
1000515-40-1
Molecular Formula:
C7H5ClN2
Molecular Weight:
152.5810
MDL Number:
MFCD09924172
IUPAC Name:
2-(4-chloropyridin-2-yl)acetonitrile
InChI:
InChI=1S/C7H5ClN2/c8-6-2-4-10-7(5-6)1-3-9/h2,4-5H,1H2
InChI Key:
JCEFJISZKHVFOP-UHFFFAOYSA-N
SMILES:
Clc1cc(CC#N)ncc1

Properties

Complexity:
149  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
152.014g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
152.581g/mol
Monoisotopic Mass:
152.014g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
36.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  

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