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155883-52-6 | 1H-Indole-2-carboxylic acid, 1-(aminocarbonyl)-2,3-dihydro-
CAS No: 155883-52-6 Catalog No: AG001OBM MDL No:
Product Description
Catalog Number:
AG001OBM
Chemical Name:
1H-Indole-2-carboxylic acid, 1-(aminocarbonyl)-2,3-dihydro-
CAS Number:
155883-52-6
Molecular Formula:
C10H10N2O3
Molecular Weight:
206.1980
IUPAC Name:
1-carbamoyl-2,3-dihydroindole-2-carboxylic acid
InChI:
InChI=1S/C10H10N2O3/c11-10(15)12-7-4-2-1-3-6(7)5-8(12)9(13)14/h1-4,8H,5H2,(H2,11,15)(H,13,14)
InChI Key:
WRPJQNDIYNQKMO-UHFFFAOYSA-N
SMILES:
NC(=O)N1C(Cc2c1cccc2)C(=O)O
Properties
Complexity:
292
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
206.069g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
206.201g/mol
Monoisotopic Mass:
206.069g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
83.6A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4
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