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146724-32-5 | 1H-Pyrrolo[3,2-h]quinoline-2-carboxylic acid, methyl ester
CAS No: 146724-32-5 Catalog No: AG001E9Z MDL No:MFCD02752316
Product Description
Catalog Number:
AG001E9Z
Chemical Name:
1H-Pyrrolo[3,2-h]quinoline-2-carboxylic acid, methyl ester
CAS Number:
146724-32-5
Molecular Formula:
C13H10N2O2
Molecular Weight:
226.2307
MDL Number:
MFCD02752316
IUPAC Name:
methyl 1H-pyrrolo[3,2-h]quinoline-2-carboxylate
InChI:
InChI=1S/C13H10N2O2/c1-17-13(16)10-7-9-5-4-8-3-2-6-14-11(8)12(9)15-10/h2-7,15H,1H3
InChI Key:
GEODGDMMLTYIFV-UHFFFAOYSA-N
SMILES:
COC(=O)c1cc2c([nH]1)c1ncccc1cc2
Properties
Complexity:
308
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
226.074g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
226.235g/mol
Monoisotopic Mass:
226.074g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
55A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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