(3-Chloropropyl)oxirane
Basic information
- CAS
19141-74-3- Standard SMILES
ClCCCC1CO1- InChIKey
LSOXTBBDZHIHDE-UHFFFAOYSA-N- Molecular formula
- C5H9ClO
- Average molar mass
- 120.58 g/mol
- Monoisotopic mass
- 120.0341926
Names & identifiers
- Preferred name
- (3-Chloropropyl)oxirane
- IUPAC
- 2-(3-chloropropyl)oxirane
- English name
- (3-chloropropyl)oxirane
- Molecular formula
- C5H9ClO
- Molecular weight
- 120.58
Names & synonyms
2-(3-chloropropyl)oxirane(3-Chloropropyl)oxirane19141-74-3EINECS 242-835-5SCHEMBL589190DTXSID50940760LSOXTBBDZHIHDE-UHFFFAOYSA-NAKOS006330697NS000489695-CHLORO-1,2-EPOXYPENTANEOxirane, 2-(3-chloropropyl)-
Database identifiers
- CAS
19141-74-3- PubChem CID
- 86828
- DTXSID
DTXSID50940760- EC Number
- 242-835-5
- Nikkaji
- J224.861A
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 12.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 3
- Heavy atoms
- 7
- Formal charge
- 0
- Complexity
- 56
Physicochemical properties
- Boiling point
- 155.2 · 155.2±13.0 °C(Predicted)
- Density
- 1.098 · 1.098±0.06 g/cm3(Predicted)
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…