1,2,3,4-Tetrahydro-β-carboline-3-carboxylic acid
Properties
- Molecular formula
- C12H12N2O2
- Molar mass
- 216.24 g/mol
- Exact mass
- 216.0899 Da
- Melting point
- 298–300 °C (decomposes)
- logP
- 1.27Crippen estimate
- Polar surface area
- 65.1 Ų
- H-bond donors / acceptors
- 3 / 2
- Rotatable bonds
- 1
Identifiers
CAS number
6052-68-2SMILES
O=C(O)C1Cc2c([nH]c3ccccc23)CN1InChIKey
FSNCEEGOMTYXKY-UHFFFAOYSA-NInChI
InChI=1S/C12H12N2O2/c15-12(16)10-5-8-7-3-1-2-4-9(7)14-11(8)6-13-10/h1-4,10,13-14H,5-6H2,(H,15,16)Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
11 names
- 1H-Pyrido[3,4-b]indole-3-carboxylic acid, 2,3,4,9-tetrahydro-
- 2,3,4,9-Tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylic acid
- 1,2,3,4-Tetrahydro-9H-pyrido[3,4-b]indole-3-carboxylic acid
- Dl-1,2,3,4-Tetrahydro-9H-pyrido[3,4-b]indole-3-carboxylic acid
- DL-1,2,3,4-Tetrahydro-3-carboxy-2-carboline
- (±)-1,2,3,4-Tetrahydro-3-carboxy-2-carboline
- NSC 96912
- 1,2,3,4-Tetrahydropyrido[3,4-b]indole-3-carboxylic acid
- Tpi
- 1H,2H,3H,4H,9H-Pyrido[3,4-b]indole-3-carboxylic acid
- 2,3,4,9-Tetrahydro-1H-β-carboline-3-carboxylic acid
Work with 1,2,3,4-Tetrahydro-β-carboline-3-carboxylic acid
Similar compounds
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1,2,3,4-Tetrahydroisoquinoline-3-carboxylic acid67123-97-152 % similar
(-)-1,2,3,4-Tetrahydroisoquinoline-3-carboxylic acid74163-81-852 % similar
1,2,3,4-Tetrahydro-3-isoquinolinecarboxylic acid hydrochloride41994-51-849 % similar
Boc-D-1,2,3,4-tetrahydronorharman-3-carboxylic acid123910-26-947 % similar
N-Methyl-L-tryptophan526-31-845 % similar
(3S)-7-Hydroxy-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid128502-56-742 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds