5-Carboxyoxindole
Properties
- Molecular formula
- C9H7NO3
- Molar mass
- 177.16 g/mol
- Exact mass
- 177.0426 Da
- logP
- 0.88Crippen estimate
- Polar surface area
- 66.4 Ų
- H-bond donors / acceptors
- 2 / 2
- Rotatable bonds
- 1
Hazards
Warning
- H302 Harmful if swallowed66.7% of notifiers
- H312 Harmful in contact with skin33.3% of notifiers
- H315 Causes skin irritation66.7% of notifiers
- H317 May cause an allergic skin reaction33.3% of notifiers
- H319 Causes serious eye irritation66.7% of notifiers
- H332 Harmful if inhaled33.3% of notifiers
- H335 May cause respiratory irritation66.7% of notifiers
Aggregated from 3 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P261, P264, P264+P265, P270, P271, P272, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P333+P317, P337+P317, P362+P364, P403+P233, P405, P501
Identifiers
CAS number
102359-00-2SMILES
C1C2=C(C=CC(=C2)C(=O)O)NC1=OInChIKey
LLLKBUWXODIMEW-UHFFFAOYSA-NInChI
InChI=1S/C9H7NO3/c11-8-4-6-3-5(9(12)13)1-2-7(6)10-8/h1-3H,4H2,(H,10,11)(H,12,13)Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
1 names
- 2-Oxindole-5-carboxylic acid
Work with 5-Carboxyoxindole
Similar compounds
5-Acetyl-2,3-dihydro-1H-indol-2-one64483-69-863 % similar
5-(Chloroacetyl)-1,3-dihydro-2H-indol-2-one65435-04-360 % similar
5-Hydroxyoxindole3416-18-059 % similar
Methyl oxindole-5-carboxylate199328-10-459 % similar
5-Chlorooxindole17630-75-055 % similar
5-Bromo-2-oxindole20870-78-455 % similar
5-Aminooxindole20876-36-255 % similar
5-Fluoro-1,3-dihydroindol-2-one56341-41-455 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.