Basic information
- CAS
61862-96-2- Standard SMILES
Cc1ccccc1-n1cc2c(c1)CCCC2- InChIKey
MWYFHPZBFWOWFV-UHFFFAOYSA-N- Molecular formula
- C15H17N
- Average molar mass
- 211.3 g/mol
- Monoisotopic mass
- 211.13609955
Names & identifiers
- Preferred name
- 2H-Isoindole, 4,5,6,7-tetrahydro-2-(2-methylphenyl)-
- IUPAC
- 2-(2-methylphenyl)-4,5,6,7-tetrahydroisoindole
Names & synonyms
61862-96-22H-Isoindole, 4,5,6,7-tetrahydro-2-(2-methylphenyl)-DTXSID504854492-(2-Methylphenyl)-4,5,6,7-tetrahydro-2H-isoindole
Database identifiers
- CAS
61862-96-2- PubChem CID
- 12295481
- DTXSID
DTXSID50485449
Properties
Computed structural properties
- XLogP
- 4.1
- Topological polar surface area
- 4.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 1
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 224
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…