Basic information
- CAS
56052-95-0- Standard SMILES
CCC[C@@H]1O[C@H]1CC- InChIKey
ZNAFWUJVHGNGIF-BQBZGAKWSA-N- Molecular formula
- C7H14O
- Average molar mass
- 114.19 g/mol
- Monoisotopic mass
- 114.10446507
Names & identifiers
- Preferred name
- 2-Ethyl-3-propyloxirane (trans)
- IUPAC
- (2S,3S)-2-ethyl-3-propyloxirane
Names & synonyms
2-ETHYL-3-PROPYLOXIRANE (TRANS)DTXSID4020460656052-95-0RefChem:260541DTXCID30127097(2S,3S)-2-ethyl-3-propyloxiraneSCHEMBL9730570
Database identifiers
- CAS
56052-95-0- PubChem CID
- 41697
- DTXSID
DTXSID40204606- Nikkaji
- J411.539B
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 12.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 3
- Heavy atoms
- 8
- Formal charge
- 0
- Complexity
- 70.8
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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