2,9-Dimethyl-beta-carbolinium
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Basic information
- CAS
37689-96-6- Standard SMILES
Cn1c2ccccc2c2cc[n+](C)cc21- InChIKey
IWZBJXJNBWUSIU-UHFFFAOYSA-N- Molecular formula
- C13H13N2+
- Average molar mass
- 197.26 g/mol
- Monoisotopic mass
- 197.10787342
Overview
inhibits mitochondrial respiration
Names & identifiers
- Preferred name
- 2,9-Dimethyl-beta-carbolinium
- IUPAC
- 2,9-dimethylpyrido[3,4-b]indol-2-ium
- English name
- 2,9-dimethyl-beta-carbolinium
- Molecular weight
- 0
Names & synonyms
2,9-dimethyl-beta-carbolinium2,9-Dimethylnorharman37689-96-6DTXSID50897169RefChem:83601DTXCID2013265862,9-dimethylpyrido[3,4-b]indol-2-ium2,9-DIMETHYL-9H-PYRIDO[3,4-B]INDOL-2-IUMCHEMBL337548SCHEMBL17940525DB-2509049H-Pyrido(3,4-b)indolium, 2,9-dimethyl-
Show more names
NS00075470
Database identifiers
- CAS
37689-96-6- PubChem CID
- 162271
- DTXSID
DTXSID50897169- ChEMBL
CHEMBL337548- Nikkaji
- J794.945F
Properties
Computed structural propertiesFilling in
- XLogP
- 2.4
- Topological polar surface area
- 8.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 0
- Heavy atoms
- 15
- Formal charge
- 1
- Complexity
- 241
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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