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10265-84-6 | 3-Quinolinecarboxylic acid, 2-methyl-4-phenyl-
CAS No: 10265-84-6 Catalog No: AG00081K MDL No:
Product Description
Catalog Number:
AG00081K
Chemical Name:
3-Quinolinecarboxylic acid, 2-methyl-4-phenyl-
CAS Number:
10265-84-6
Molecular Formula:
C17H13NO2
Molecular Weight:
263.2906
IUPAC Name:
2-methyl-4-phenylquinoline-3-carboxylic acid
InChI:
InChI=1S/C17H13NO2/c1-11-15(17(19)20)16(12-7-3-2-4-8-12)13-9-5-6-10-14(13)18-11/h2-10H,1H3,(H,19,20)
InChI Key:
XGOVHQRZEWXRBV-UHFFFAOYSA-N
SMILES:
OC(=O)c1c(C)nc2c(c1c1ccccc1)cccc2
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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