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54864-83-4 | 6-Chloro-N,N-dimethylnicotinamide
CAS No: 54864-83-4 Catalog No: AG003N6Q MDL No:MFCD08588286
Product Description
Catalog Number:
AG003N6Q
Chemical Name:
6-Chloro-N,N-dimethylnicotinamide
CAS Number:
54864-83-4
Molecular Formula:
C8H9ClN2O
Molecular Weight:
184.6229
MDL Number:
MFCD08588286
IUPAC Name:
6-chloro-N,N-dimethylpyridine-3-carboxamide
InChI:
InChI=1S/C8H9ClN2O/c1-11(2)8(12)6-3-4-7(9)10-5-6/h3-5H,1-2H3
InChI Key:
BPMBBXCPGAFTCX-UHFFFAOYSA-N
SMILES:
Clc1ccc(cn1)C(=O)N(C)C
Properties
Complexity:
172
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
184.04g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
184.623g/mol
Monoisotopic Mass:
184.04g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
33.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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