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Home > Bromides > 1157457-17-4
1157457-17-4 | Benzamide, N-(5-bromo-2-methylphenyl)-3-cyano-
CAS No: 1157457-17-4 Catalog No: AG000GT1 MDL No:MFCD12719083
Product Description
Catalog Number:
AG000GT1
Chemical Name:
Benzamide, N-(5-bromo-2-methylphenyl)-3-cyano-
CAS Number:
1157457-17-4
Molecular Formula:
C15H11BrN2O
Molecular Weight:
315.1646
MDL Number:
MFCD12719083
IUPAC Name:
N-(5-bromo-2-methylphenyl)-3-cyanobenzamide
InChI:
InChI=1S/C15H11BrN2O/c1-10-5-6-13(16)8-14(10)18-15(19)12-4-2-3-11(7-12)9-17/h2-8H,1H3,(H,18,19)
InChI Key:
VPXLEUZUEFZJTF-UHFFFAOYSA-N
SMILES:
N#Cc1cccc(c1)C(=O)Nc1cc(Br)ccc1C
Properties
Complexity:
376
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
314.005g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
315.17g/mol
Monoisotopic Mass:
314.005g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
52.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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