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1150618-20-4 | 7-Quinolinecarboxylic acid, 4-chloro-2-methyl-
CAS No: 1150618-20-4 Catalog No: AG000FU8 MDL No:MFCD12024478
Product Description
Catalog Number:
AG000FU8
Chemical Name:
7-Quinolinecarboxylic acid, 4-chloro-2-methyl-
CAS Number:
1150618-20-4
Molecular Formula:
C11H8ClNO2
Molecular Weight:
221.6397
MDL Number:
MFCD12024478
IUPAC Name:
4-chloro-2-methylquinoline-7-carboxylic acid
InChI:
InChI=1S/C11H8ClNO2/c1-6-4-9(12)8-3-2-7(11(14)15)5-10(8)13-6/h2-5H,1H3,(H,14,15)
InChI Key:
OYEQPWTUUHEXCQ-UHFFFAOYSA-N
SMILES:
Cc1cc(Cl)c2c(n1)cc(cc2)C(=O)O
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:
2.7
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