1,2,3,7-Tetramethylindole

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Basic information

Standard SMILES: Cc1c(C)n(C)c2c(C)cccc12
InChIKey: XFMIBSDZPCAMEH-UHFFFAOYSA-N
Molecular formula: C12H15N
Average molar mass: 173.25 g/mol
Monoisotopic mass: 173.12044948

Names & identifiers

Preferred name: 1,2,3,7-Tetramethylindole
IUPAC: 1,2,3,7-tetramethylindole

Names & synonyms

1,2,3,7-Tetramethylindole1,2,3,7-Tetramethyl-1H-indoleSCHEMBL25534616SCHEMBL30583770XFMIBSDZPCAMEH-UHFFFAOYSA-NDTXSID601362104STK2496601,2,3,7-Tetramethyl-1H-indole #AKOS005422958Q63395813

Database identifiers

PubChem CID: 599503
DTXSID: DTXSID601362104
Nikkaji: J46.763D

Properties

Computed structural properties

XLogP: 3.1
Topological polar surface area: 4.9 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 0
Rotatable bonds: 0
Heavy atoms: 13
Formal charge: 0
Complexity: 190

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Compound notes

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