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204782-99-0

204782-99-0 | 7-Quinolinecarboxylic acid, 8-methyl-

CAS No: 204782-99-0 Catalog No: AG0029P7 MDL No:

Product Description

Catalog Number:
AG0029P7
Chemical Name:
7-Quinolinecarboxylic acid, 8-methyl-
CAS Number:
204782-99-0
Molecular Formula:
C11H9NO2
Molecular Weight:
187.1947
IUPAC Name:
8-methylquinoline-7-carboxylic acid
InChI:
InChI=1S/C11H9NO2/c1-7-9(11(13)14)5-4-8-3-2-6-12-10(7)8/h2-6H,1H3,(H,13,14)
InChI Key:
NBITZNUMCXMLHB-UHFFFAOYSA-N
SMILES:
OC(=O)c1ccc2c(c1C)nccc2

Properties

Complexity:
229  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
187.063g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
187.198g/mol
Monoisotopic Mass:
187.063g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
50.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  

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