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76577-83-8 | Pyrrolo[1,2-a]quinoline-2-carboxylic acid
CAS No: 76577-83-8 Catalog No: AG005KGK MDL No:
Product Description
Catalog Number:
AG005KGK
Chemical Name:
Pyrrolo[1,2-a]quinoline-2-carboxylic acid
CAS Number:
76577-83-8
Molecular Formula:
C13H9NO2
Molecular Weight:
211.2161
IUPAC Name:
pyrrolo[1,2-a]quinoline-2-carboxylic acid
InChI:
InChI=1S/C13H9NO2/c15-13(16)10-7-11-6-5-9-3-1-2-4-12(9)14(11)8-10/h1-8H,(H,15,16)
InChI Key:
LVFHEKCPDLJEGQ-UHFFFAOYSA-N
SMILES:
OC(=O)c1cn2c(c1)ccc1c2cccc1
Properties
Complexity:
292
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
211.063g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
211.22g/mol
Monoisotopic Mass:
211.063g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
41.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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