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181048-54-4 | 4-Quinolinecarboxylic acid, 7-methyl-2-phenyl-
CAS No: 181048-54-4 Catalog No: AG0022MQ MDL No:MFCD00178354
Product Description
Catalog Number:
AG0022MQ
Chemical Name:
4-Quinolinecarboxylic acid, 7-methyl-2-phenyl-
CAS Number:
181048-54-4
Molecular Formula:
C17H13NO2
Molecular Weight:
263.2906
MDL Number:
MFCD00178354
IUPAC Name:
7-methyl-2-phenylquinoline-4-carboxylic acid
InChI:
InChI=1S/C17H13NO2/c1-11-7-8-13-14(17(19)20)10-15(18-16(13)9-11)12-5-3-2-4-6-12/h2-10H,1H3,(H,19,20)
InChI Key:
FTDDWOPSQXABQF-UHFFFAOYSA-N
SMILES:
Cc1ccc2c(c1)nc(cc2C(=O)O)c1ccccc1
Properties
Complexity:
351
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
263.095g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
263.296g/mol
Monoisotopic Mass:
263.095g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
50.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
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