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155983-19-0 | 3-Quinolinecarboxylic acid, 2-chloro-7-methyl-
CAS No: 155983-19-0 Catalog No: AG001OE9 MDL No:
Product Description
Catalog Number:
AG001OE9
Chemical Name:
3-Quinolinecarboxylic acid, 2-chloro-7-methyl-
CAS Number:
155983-19-0
Molecular Formula:
C11H8ClNO2
Molecular Weight:
221.6397
IUPAC Name:
2-chloro-7-methylquinoline-3-carboxylic acid
InChI:
InChI=1S/C11H8ClNO2/c1-6-2-3-7-5-8(11(14)15)10(12)13-9(7)4-6/h2-5H,1H3,(H,14,15)
InChI Key:
KIVCVRKPLHOFGB-UHFFFAOYSA-N
SMILES:
Cc1ccc2c(c1)nc(c(c2)C(=O)O)Cl
Properties
Complexity:
259
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
221.024g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
221.64g/mol
Monoisotopic Mass:
221.024g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
50.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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