Basic information
- CAS
18233-71-1- Standard SMILES
CC1=NCc2ccccc2CN1- InChIKey
JBJMNDQSNKPJDR-UHFFFAOYSA-N- Molecular formula
- C10H12N2
- Average molar mass
- 160.22 g/mol
- Monoisotopic mass
- 160.10004839
Names & identifiers
- Preferred name
- 2,5-Dihydro-3-methyl-1H-2,4-benzodiazepine
- IUPAC
- 3-methyl-2,5-dihydro-1H-2,4-benzodiazepine
- English name
- 2,5-Dihydro-3-methyl-1H-2,4-benzodiazepine
- Molecular weight
- 0
Names & synonyms
18233-71-12,5-Dihydro-3-methyl-1H-2,4-benzodiazepineRefChem:2474593-Methyl-2,5-dihydro-1H-2,4-benzodiazepine1H-2,4-Benzodiazepine, 2,5-dihydro-3-methyl-SCHEMBL14817733JBJMNDQSNKPJDR-UHFFFAOYSA-NDTXSID0012689983-Methyl-2,5-dihydro-1H-2,4-benzodiazepine #
Database identifiers
- CAS
18233-71-1- PubChem CID
- 577109
- DTXSID
DTXSID001268998- Nikkaji
- J112.965A
Properties
Computed structural properties
- XLogP
- 0.7
- Topological polar surface area
- 24.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 186
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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