Basic information
- CAS
187-29-1- Standard SMILES
C1C2OC2C2OC12- InChIKey
SIWFRAYSJGYECR-UHFFFAOYSA-N- Molecular formula
- C5H6O2
- Average molar mass
- 98.1 g/mol
- Monoisotopic mass
- 98.03677943
Names & identifiers
- Preferred name
- 1,2:3,4-Diepoxycyclopentane
- IUPAC
- 3,7-dioxatricyclo[4.1.0.02,4]heptane
- English name
- 1,2,4,5-Diepoxypentane
- Molecular formula
- C5H6O2
- Molecular weight
- 98.1
Names & synonyms
1,2:3,4-Diepoxycyclopentane3,7-Dioxatricyclo(4.1.0.0(sup 2,4))heptaneSCHEMBL3183419DTXSID30940162NSC128289NSC-1282893,7-Dioxatricyclo[4.1.0.0~2,4~]heptaneMethylenebisoxirane1,2,4,5-Diepoxypentane2,2'-Methylenebisoxirane3,7-Dioxatricyclo[4.1.0.02,4]heptane
Database identifiers
- CAS
187-29-1- PubChem CID
- 67443
- DTXSID
DTXSID30940162- Nikkaji
- J1.129.737D
Properties
Computed structural properties
- XLogP
- -0.1
- Topological polar surface area
- 25.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 7
- Formal charge
- 0
- Complexity
- 109
Physicochemical properties
- Boiling point
- 204.9 · 204.9±8.0 °C(Predicted)
- Density
- 1.435 · 1.435±0.06 g/cm3(Predicted)
- FDA UNII
- 272949 Q · MVC272949Q
Chemistry & industry
Suppliers1 total
广州和为医药科技有限公司17612033329 17612033329 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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