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1365272-05-4 | [1,1'-Biphenyl]-3-carboxamide, 2'-cyano-N-methyl-
CAS No: 1365272-05-4 Catalog No: AG0011ZO MDL No:MFCD21609621
Product Description
Catalog Number:
AG0011ZO
Chemical Name:
[1,1'-Biphenyl]-3-carboxamide, 2'-cyano-N-methyl-
CAS Number:
1365272-05-4
Molecular Formula:
C15H12N2O
Molecular Weight:
236.2686
MDL Number:
MFCD21609621
IUPAC Name:
3-(2-cyanophenyl)-N-methylbenzamide
InChI:
InChI=1S/C15H12N2O/c1-17-15(18)12-7-4-6-11(9-12)14-8-3-2-5-13(14)10-16/h2-9H,1H3,(H,17,18)
InChI Key:
SGLOTVGJRDAHFM-UHFFFAOYSA-N
SMILES:
CNC(=O)c1cccc(c1)c1ccccc1C#N
Properties
Complexity:
344
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
236.095g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
236.274g/mol
Monoisotopic Mass:
236.095g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
52.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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