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1375069-01-4 | [1,1'-Biphenyl]-4-acetic acid, 3'-[(methylamino)carbonyl]-
CAS No: 1375069-01-4 Catalog No: AG0013FZ MDL No:MFCD22205789
Product Description
Catalog Number:
AG0013FZ
Chemical Name:
[1,1'-Biphenyl]-4-acetic acid, 3'-[(methylamino)carbonyl]-
CAS Number:
1375069-01-4
Molecular Formula:
C16H15NO3
Molecular Weight:
269.2952
MDL Number:
MFCD22205789
IUPAC Name:
2-[4-[3-(methylcarbamoyl)phenyl]phenyl]acetic acid
InChI:
InChI=1S/C16H15NO3/c1-17-16(20)14-4-2-3-13(10-14)12-7-5-11(6-8-12)9-15(18)19/h2-8,10H,9H2,1H3,(H,17,20)(H,18,19)
InChI Key:
RGWAOZXNNHYCTR-UHFFFAOYSA-N
SMILES:
CNC(=O)c1cccc(c1)c1ccc(cc1)CC(=O)O
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:
2
Isotope Atom Count:
0
Molecular Weight:
269.3g/mol
Monoisotopic Mass:
269.105g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
66.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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