chempirical

1H-Benzimidazole-2-propanoic acid

C10H10N2O2CAS 23249-97-0190.20 g/mol

Open in Covalent MOL file
OOHNNH
Carboxylic acid

Properties

Molecular formula
C10H10N2O2
Molar mass
190.20 g/mol
Exact mass
190.0742 Da
Melting point
228 °C (decomposes)
logP
1.58Crippen estimate
Polar surface area
66.0 Ų
H-bond donors / acceptors
2 / 2
Rotatable bonds
3

Identifiers

CAS number
23249-97-0
SMILES
O=C(O)CCc1nc2ccccc2[nH]1
InChIKey
XYWJNTOURDMTPI-UHFFFAOYSA-N
InChI
InChI=1S/C10H10N2O2/c13-10(14)6-5-9-11-7-3-1-2-4-8(7)12-9/h1-4H,5-6H2,(H,11,12)(H,13,14)

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

12 names
  • 2-Benzimidazolepropionic acid
  • 2-(2-Carboxyethyl)benzimidazole
  • (2-Benzimidazolyl)propionic acid
  • Propazol
  • Procodazol
  • Procodazole
  • 3-(2-Benzimidazolyl)propionic acid
  • AL 1241
  • Estimulocel
  • NSC 35790
  • 3-(1H-Benzimidazol-2-yl)propionic acid
  • 3-(1H-Benzimidazol-2-yl)propanoic acid

Work with 1H-Benzimidazole-2-propanoic acid

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

1H-Benzimidazole-2-propanol2403-66-954 % similar 2-Propyl-1H-benzimidazole5465-29-253 % similar 1H-Benzimidazole-2-methanol4856-97-751 % similar 1H-Benzimidazole-2-carboxylic acid2849-93-650 % similar 1H-Indole-3-propanoic acid830-96-650 % similar 2-Pentyl-1H-benzimidazole5851-46-749 % similar 2-Ethylbenzimidazole1848-84-647 % similar 2-(Chloromethyl)benzimidazole4857-04-947 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

Methyl 4-amino-6-indolecarboxylate121561-15-7 3-Benzoimidazol-1-yl-propionic acid14840-18-7 Ethyl pyrazolo(1,5-a)pyridine-3-carboxylate16205-44-0 L-4-Cyanophenylalanine167479-78-9 2,3-Dimethyl-5-nitro-1H-indole21296-94-6 2-Cyano-D-phenylalanine263396-41-4 3-Cyano-D-phenylalanine263396-43-6 5-(Phenylmethyl)-2,4-imidazolidinedione3530-82-3

Elsewhere

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