Basic information
- CAS
738608-71-4- Standard SMILES
CCc1cc2c([nH]c3ccccc32)c(C)n1- InChIKey
ZUDVCBXDHGAKBX-UHFFFAOYSA-N- Molecular formula
- C14H14N2
- Average molar mass
- 210.27 g/mol
- Monoisotopic mass
- 210.11569846
Names & identifiers
- Preferred name
- 3-Ethyl-1-methyl-9H-pyrido[3,4-B]indole
- IUPAC
- 3-ethyl-1-methyl-9H-pyrido[3,4-b]indole
- English name
- 9H-Pyrido[3,4-b]indole,3-ethyl-1-methyl-(9CI)
- Molecular formula
- C14H14N2
- Molecular weight
- 210.27436
Names & synonyms
3-ETHYL-1-METHYL-9H-PYRIDO[3,4-B]INDOLE738608-71-4SCHEMBL29817742DB-3664609H-Pyrido[3,4-b]indole,3-ethyl-1-methyl-(9CI)
Database identifiers
- CAS
738608-71-4- PubChem CID
- 45094955
- Nikkaji
- J2.062.895B
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 28.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 253
Chemistry & industry
Suppliers1 total
CHEMSTEP[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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