5,7-Difluoroindole-2-carboxylic acid
Properties
- Molecular formula
- C9H5F2NO2
- Molar mass
- 197.14 g/mol
- Exact mass
- 197.0288 Da
- logP
- 2.14Crippen estimate
- Polar surface area
- 53.1 Ų
- H-bond donors / acceptors
- 2 / 1
- Rotatable bonds
- 1
Hazards
Warning
- H302 Harmful if swallowed100% of notifiers
- H315 Causes skin irritation100% of notifiers
- H319 Causes serious eye irritation100% of notifiers
- H335 May cause respiratory irritation100% of notifiers
Aggregated from 2 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501
Identifiers
CAS number
186432-20-2SMILES
C1=C2C=C(NC2=C(C=C1F)F)C(=O)OInChIKey
WVZUEYDXSLBMEK-UHFFFAOYSA-NInChI
InChI=1S/C9H5F2NO2/c10-5-1-4-2-7(9(13)14)12-8(4)6(11)3-5/h1-3,12H,(H,13,14)Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
1 names
- 5,7-Difluoro-1H-indole-2-carboxylic acid
Work with 5,7-Difluoroindole-2-carboxylic acid
Similar compounds
5-Fluoroindole-2-carboxylic acid399-76-857 % similar
5-Fluoro-1H-pyrrolo[2,3-B]pyridine-2-carboxylic acid920978-94-556 % similar
6-Fluoroindole-2-carboxylic acid3093-97-854 % similar
2,4,6-Trifluorobenzoic acid28314-80-953 % similar
5,7-Dichloro-1H-indole-2-carboxylic acid4792-71-649 % similar
7-Chloro-1H-indole-2-carboxylic acid28899-75-448 % similar
2,3,5-Trifluorobenzoic acid654-87-548 % similar
7-Hydroxy-1H-indole-2-carboxylic acid84639-84-947 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds