1,2,3-Trimethyl-1-phenylindan
Basic information
- CAS
33603-39-3- Standard SMILES
CC1c2ccccc2C(C)(c2ccccc2)C1C- InChIKey
NQOSQRWPGXBONH-UHFFFAOYSA-N- Molecular formula
- C18H20
- Average molar mass
- 236.4 g/mol
- Monoisotopic mass
- 236.15650064
Names & identifiers
- Preferred name
- 1,2,3-Trimethyl-1-phenylindan
- IUPAC
- 1,2,3-trimethyl-3-phenyl-1,2-dihydroindene
Names & synonyms
33603-39-31,2,3-Trimethyl-1-phenylindan stereoisomer1,2,3-TRIMETHYL-1-PHENYLINDAN1,2,3-Trimethyl-1-phenyl-2,3-dihydro-1H-indeneSCHEMBL28194266DTXSID7095523533611-16-4
Database identifiers
- CAS
33603-39-3、33611-16-4- PubChem CID
- 36559
- DTXSID
DTXSID70955235- Nikkaji
- J1.616.979J
Properties
Computed structural properties
- XLogP
- 5.3
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 1
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 288
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…