chempirical

(±)-Indoline-2-carboxylic acid

C9H9NO2CAS 16851-56-2163.18 g/mol

Open in Covalent MOL file
OOHNH
AlcoholCarboxylic AcidSecondary Amine

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

Identifiers

CAS number
16851-56-2
SMILES
O=C(O)C1Cc2ccccc2N1
InChIKey
QNRXNRGSOJZINA-UHFFFAOYSA-N
InChI
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

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Same formula

2,6-Diacetylpyridine1129-30-2 1-Phenyl-1,2-propanedione 2-oxime119-51-7 4-Acetamidobenzaldehyde122-85-0 2,6-Dimethoxybenzonitrile16932-49-3 2,5-Dimethyl-β-oxo-3-furanpropanenitrile175276-62-7 3,5-Dimethoxybenzonitrile19179-31-8 3,4-Dimethoxybenzonitrile2024-83-1 7-Hydroxy-3,4-dihydro-2(1H)-quinolinone22246-18-0

Elsewhere

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