Home Halogens 3-Pyridinecarbonitrile, 5-(chloromethyl)-, hydrochloride (1:1)

3-Pyridinecarbonitrile, 5-(chloromethyl)-, hydrochloride (1:1)

CAS No.:
189936-27-4
Catalog Number:
AG002E59
Molecular Formula:
C7H6Cl2N2
Molecular Weight:
189.0419
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Product Description
Catalog Number:
AG002E59
Chemical Name:
3-Pyridinecarbonitrile, 5-(chloromethyl)-, hydrochloride (1:1)
CAS Number:
189936-27-4
Molecular Formula:
C7H6Cl2N2
Molecular Weight:
189.0419
MDL Number:
MFCD28252259
IUPAC Name:
5-(chloromethyl)pyridine-3-carbonitrile;hydrochloride
InChI:
InChI=1S/C7H5ClN2.ClH/c8-2-6-1-7(3-9)5-10-4-6;/h1,4-5H,2H2;1H
InChI Key:
JBHXSCWBUYDTDR-UHFFFAOYSA-N
SMILES:
ClCc1cncc(c1)C#N.Cl
Properties
Complexity:
149  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
187.991g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
189.039g/mol
Monoisotopic Mass:
187.991g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
36.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties