Basic information
- CAS
311-75-1- Standard SMILES
C1C2CC1C2- InChIKey
MKCBRYIXFFGIKN-UHFFFAOYSA-N- Molecular formula
- C5H8
- Average molar mass
- 68.12 g/mol
- Monoisotopic mass
- 68.06260026
Names & identifiers
- Preferred name
- Bicyclo(1.1.1)pentane
- IUPAC
- bicyclo[1.1.1]pentane
- English name
- bicyclo[1.1.1]pentane
- Molecular formula
- C5H8
- Molecular weight
- 68.12
Names & synonyms
Bicyclo[1.1.1]pentane311-75-1Bicyclo(1.1.1)pentaneRefChem:119665[1]StaffaneSCHEMBL24236SCHEMBL222684SCHEMBL261801SCHEMBL7157026SCHEMBL9383231SCHEMBL19253231DTXSID60185044
Show more names
EOS-62111
Database identifiers
- CAS
311-75-1- PubChem CID
- 136153
- DTXSID
DTXSID60185044- Nikkaji
- J625.970G
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 0
- Rotatable bonds
- 0
- Heavy atoms
- 5
- Formal charge
- 0
- Complexity
- 28.5
Experimental & physicochemical properties
SpringerMaterials PropertiesSchoenflies notation
Physicochemical properties
- Boiling point
- 49.1 · 49.1±7.0 °C(Predicted)
- Density
- 0.976 · 0.976±0.06 g/cm3(Predicted)
Chemistry & industry
Upstream & downstream products
Downstream products
Suppliers3 total
成都同创源医药科技有限公司028-83379370 13880556291 · [email protected]
德州博腾精细化工有限公司[email protected]
上海万千化工有限公司18796480002 18796480002 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…