Basic information
- CAS
1139-82-8- Standard SMILES
O=C1Cc2ccccc2-c2ccccc2C1- InChIKey
YGWVVRDRBWXLNX-UHFFFAOYSA-N- Molecular formula
- C15H12O
- Average molar mass
- 208.25 g/mol
- Monoisotopic mass
- 208.088815
Names & identifiers
- Preferred name
- 6H-Dibenzo(a,c)cyclohepten-6-one, 5,7-dihydro-
- IUPAC
- tricyclo[9.4.0.02,7]pentadeca-1(15),2,4,6,11,13-hexaen-9-one
- English name
- 6H-Dibenzo[a,c]cyclohepten-6-one,5,7-dihydro-
- Molecular formula
- C15H12O
- Molecular weight
- 208.26
Names & synonyms
1139-82-86H-Dibenzo(a,c)cyclohepten-6-one, 5,7-dihydro-6H-Dibenzo[a, 5,7-dihydro-5,7-dihydro-6H-dibenzo[a,c]cyclohepten-6-one5,7-dihydro-6H-dibenzo[a,c][7]annulen-6-oneNSC73051tricyclo[9.4.0.02,7]pentadeca-1(15),2,4,6,11,13-hexaen-9-oneNCIOpen2_003556SCHEMBL4987541DTXSID90150609YGWVVRDRBWXLNX-UHFFFAOYSA-NNSC 73051
Show more names
6H-Dibenzo[a,c]cyclohepten-6-one,5,7-dihydro-
NSC-73051AP-406/41885704
Database identifiers
- CAS
1139-82-8- PubChem CID
- 14351
- DTXSID
DTXSID90150609- Nikkaji
- J1.948.105K
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 245
Physicochemical properties
- Melting point
- 78 °C · 78 °C(Solv: ethanol (64-17-5))
- Boiling point
- 307.46 °C · 307.46°C (rough estimate)
- Density
- 1.0459 · 1.0459 (rough estimate)
- refractive index
- 1.5361 · 1.5361 (estimate)
Chemistry & industry
Suppliers2 total
骓慕化学（天津）有限公司13116033143 17602663561 · [email protected]
箴德化工科技（上海）有限公司15601952568 · [email protected]
Related reactions
13 records
Compound notes
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