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893737-74-1 | Methyl 4'-(acetylamino)[1,1'-biphenyl]-3-carboxylate
CAS No: 893737-74-1 Catalog No: AG01F8N6 MDL No:
Product Description
Catalog Number:
AG01F8N6
Chemical Name:
Methyl 4'-(acetylamino)[1,1'-biphenyl]-3-carboxylate
CAS Number:
893737-74-1
Molecular Formula:
C16H15NO3
Molecular Weight:
269.2952
IUPAC Name:
methyl 3-(4-acetamidophenyl)benzoate
InChI:
InChI=1S/C16H15NO3/c1-11(18)17-15-8-6-12(7-9-15)13-4-3-5-14(10-13)16(19)20-2/h3-10H,1-2H3,(H,17,18)
InChI Key:
ZVQBIAKEBSBNRB-UHFFFAOYSA-N
SMILES:
COC(=O)c1cccc(c1)c1ccc(cc1)NC(=O)C
Properties
Complexity:
348
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
269.105g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
269.3g/mol
Monoisotopic Mass:
269.105g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
55.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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