2-Oxabicyclo[3.2.0]hepta-3,6-diene
Basic information
- CAS
13920-54-2- Standard SMILES
C1=CC2C=CC2O1- InChIKey
QYLMHRXTFJNXPK-UHFFFAOYSA-N- Molecular formula
- C6H6O
- Average molar mass
- 94.11 g/mol
- Monoisotopic mass
- 94.04186481
Names & identifiers
- Preferred name
- 2-Oxabicyclo[3.2.0]hepta-3,6-diene
- IUPAC
- 2-oxabicyclo[3.2.0]hepta-3,6-diene
Names & synonyms
2-Oxabicyclo[3.2.0]hepta-3,6-diene13920-54-22-Oxabicyclo(3.2.0)hepta-3,6-dieneDTXSID30338464RefChem:264556DTXCID90289549QYLMHRXTFJNXPK-UHFFFAOYSA-N
Database identifiers
- CAS
13920-54-2- PubChem CID
- 549248
- DTXSID
DTXSID30338464
Properties
Computed structural properties
- XLogP
- 1
- Topological polar surface area
- 9.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 7
- Formal charge
- 0
- Complexity
- 135
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…