(±)-Indoline-2-carboxylic acid
Properties
- Molecular formula
- C9H9NO2
- Molar mass
- 163.18 g/mol
- Exact mass
- 163.0633 Da
- logP
- 1.11Crippen estimate
- Polar surface area
- 49.3 Ų
- H-bond donors / acceptors
- 2 / 2
- Rotatable bonds
- 1
Hazards
Warning
- H317 May cause an allergic skin reaction100% of notifiers
- H361 Suspected of damaging fertility or the unborn child100% of notifiers
Aggregated from 45 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P203, P261, P272, P280, P302+P352, P318, P321, P333+P317, P362+P364, P405, P501
Identifiers
CAS number
78348-24-0SMILES
O=C(O)C1Cc2ccccc2N1InChIKey
QNRXNRGSOJZINA-UHFFFAOYSA-NInChI
InChI=1S/C9H9NO2/c11-9(12)8-5-6-3-1-2-4-7(6)10-8/h1-4,8,10H,5H2,(H,11,12)Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
5 names
- 1H-Indole-2-carboxylic acid, 2,3-dihydro-
- 2,3-Dihydro-1H-indole-2-carboxylic acid
- Indoline-2-carboxylic acid
- 2,3-Dihydroindole-2-carboxylic acid
- (±)-2,3-Dihydroindole-2-carboxylic acid
Work with (±)-Indoline-2-carboxylic acid
Stereoisomers, salts and isotopologues
The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.
Similar compounds
(3R)-1,2,3,4-Tetrahydroisoquinoline-3-carboxylic acid103733-65-961 % similar
1,2,3,4-Tetrahydroisoquinoline-3-carboxylic acid67123-97-161 % similar
(-)-1,2,3,4-Tetrahydroisoquinoline-3-carboxylic acid74163-81-861 % similar
1,2,3,4-Tetrahydro-3-isoquinolinecarboxylic acid hydrochloride41994-51-856 % similar
2-Indancarboxylic acid25177-85-953 % similar
2,3-Dihydrobenzofuran-2-carboxylic acid1914-60-945 % similar
Indoline-3-carboxylic acid39891-70-845 % similar
N-Methyl-L-tryptophan526-31-845 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.