Basic information
- CAS
5649-95-6- Standard SMILES
C1=CC2C=CC12- InChIKey
CTLSARLLLBZBRV-UHFFFAOYSA-N- Molecular formula
- C6H6
- Average molar mass
- 78.11 g/mol
- Monoisotopic mass
- 78.04695019
Names & identifiers
- Preferred name
- Bicyclo[2.2.0]hexa-2,5-diene
- IUPAC
- bicyclo[2.2.0]hexa-2,5-diene
- English name
- Bicyclo[2.2.0]hexa-2,5-diene
- Molecular formula
- C6H6
- Molecular weight
- 78.11
Names & synonyms
Dewar benzeneBicyclo[2.2.0]hexa-2,5-dieneTecteneBicyclo(2.2.0)hexa-2,5-diene885QNL8RTBTECTADIENENSC-167530DTXSID00205033NSC 167530CIS-BICYCLO(2.2.0)HEXA-2,5-DIENERefChem:119669DTXCID00127524
Show more names
5649-95-6dewar-benzeneNSC167530UNII-885QNL8RTBSCHEMBL1362754SCHEMBL3929943Q425101
Database identifiers
- CAS
5649-95-6- PubChem CID
- 98808
- DTXSID
DTXSID00205033- UNII
- 885QNL8RTB
- Nikkaji
- J55.588F
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 0
- Heavy atoms
- 6
- Formal charge
- 0
- Complexity
- 92
Physicochemical properties
- FDA UNII
- 885 QNL8RTB · 885QNL8RTB
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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