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Home > Pyridines > 116275-39-9
116275-39-9 | 2-Pyridinecarboxamide, 4-chloro-N-(phenylmethyl)-
CAS No: 116275-39-9 Catalog No: AG000C33 MDL No:MFCD11177039
Product Description
Catalog Number:
AG000C33
Chemical Name:
2-Pyridinecarboxamide, 4-chloro-N-(phenylmethyl)-
CAS Number:
116275-39-9
Molecular Formula:
C13H11ClN2O
Molecular Weight:
246.6922
MDL Number:
MFCD11177039
IUPAC Name:
N-benzyl-4-chloropyridine-2-carboxamide
InChI:
InChI=1S/C13H11ClN2O/c14-11-6-7-15-12(8-11)13(17)16-9-10-4-2-1-3-5-10/h1-8H,9H2,(H,16,17)
InChI Key:
XNKYZWCVSFIEPN-UHFFFAOYSA-N
SMILES:
Clc1ccnc(c1)C(=O)NCc1ccccc1
Properties
Complexity:
254
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
246.056g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
246.694g/mol
Monoisotopic Mass:
246.056g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
42A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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