Basic information
- CAS
157-41-5- Standard SMILES
C1CC12CO2- InChIKey
KSOGAEPLTWOWJN-UHFFFAOYSA-N- Molecular formula
- C4H6O
- Average molar mass
- 70.09 g/mol
- Monoisotopic mass
- 70.04186481
Names & identifiers
- Preferred name
- 1-Oxaspiro(2.2)pentane
- IUPAC
- 1-oxaspiro[2.2]pentane
- English name
- Oxaspiropentane
- Molecular formula
- C4H6O
- Molecular weight
- 70.09
Names & synonyms
1-oxaspiro[2.2]pentane157-41-5DTXSID604948251-Oxaspiro(2.2)pentaneRefChem:232748DTXCID60445635oxaspiropentane5-oxaspiro[2.2]pentane1-oxa-spiro[2.2]pentaneSCHEMBL3829401SCHEMBL23612014KSOGAEPLTWOWJN-UHFFFAOYSA-N
Show more names
DB-126963
Database identifiers
- CAS
157-41-5- PubChem CID
- 12371157
- DTXSID
DTXSID60494825
Properties
Computed structural properties
- XLogP
- 0.2
- Topological polar surface area
- 12.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 5
- Formal charge
- 0
- Complexity
- 64
Experimental & physicochemical properties
SpringerMaterials PropertiesSchoenflies notation
Physicochemical properties
- Boiling point
- 83.1 · 83.1±8.0 °C(Predicted)
- Density
- 1.11 · 1.11±0.1 g/cm3(Predicted)
Chemistry & industry
Suppliers2 total
Dr. Silviu Pharmachem Pvt., Ltd.[email protected]
Service Chemical Inc.[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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