5-Hydroxyindole-2-carboxylic acid
Properties
- Molecular formula
- C9H7NO3
- Molar mass
- 177.16 g/mol
- Exact mass
- 177.0426 Da
- Melting point
- 246 °C (decomposes)
- logP
- 1.57Crippen estimate
- Polar surface area
- 73.3 Ų
- H-bond donors / acceptors
- 3 / 2
- Rotatable bonds
- 1
Hazards
Warning
- H315 Causes skin irritation100% of notifiers
- H319 Causes serious eye irritation100% of notifiers
- H335 May cause respiratory irritation100% of notifiers
Aggregated from 45 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501
Identifiers
CAS number
21598-06-1SMILES
O=C(O)c1cc2cc(O)ccc2[nH]1InChIKey
BIMHWDJKNOMNLD-UHFFFAOYSA-NInChI
InChI=1S/C9H7NO3/c11-6-1-2-7-5(3-6)4-8(10-7)9(12)13/h1-4,10-11H,(H,12,13)Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
4 names
- 1H-Indole-2-carboxylic acid, 5-hydroxy-
- Indole-2-carboxylic acid, 5-hydroxy-
- 5-Hydroxy-1H-indole-2-carboxylic acid
- NSC 117338
Work with 5-Hydroxyindole-2-carboxylic acid
Similar compounds
5-Bromo-1H-indole-2-carboxylic acid7254-19-569 % similar
Indole-2,5-dicarboxylic acid117140-77-969 % similar
5-Methylindole-2-carboxylic acid10241-97-165 % similar
5-Chloro-1H-indole-2-carboxylic acid10517-21-265 % similar
5-Amino-1H-indole-2-carboxylic acid152213-40-665 % similar
5-Fluoroindole-2-carboxylic acid399-76-865 % similar
Indole-2-carboxylic acid1477-50-563 % similar
5-Methoxy-1H-indole-2-carboxylic acid4382-54-160 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.