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131776-36-8 | Benzo[g]quinoline-3-carboxylic acid, 4-hydroxy-
CAS No: 131776-36-8 Catalog No: AG000ZQ9 MDL No:
Product Description
Catalog Number:
AG000ZQ9
Chemical Name:
Benzo[g]quinoline-3-carboxylic acid, 4-hydroxy-
CAS Number:
131776-36-8
Molecular Formula:
C14H9NO3
Molecular Weight:
239.2262
IUPAC Name:
4-oxo-1H-benzo[g]quinoline-3-carboxylic acid
InChI:
InChI=1S/C14H9NO3/c16-13-10-5-8-3-1-2-4-9(8)6-12(10)15-7-11(13)14(17)18/h1-7H,(H,15,16)(H,17,18)
InChI Key:
RZRAAGLOYDDKQD-UHFFFAOYSA-N
SMILES:
OC(=O)c1cnc2c(c1O)cc1c(c2)cccc1
Properties
Complexity:
415
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
239.058g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
239.23g/mol
Monoisotopic Mass:
239.058g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
66.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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