Basic information
- CAS
42468-64-4- Standard SMILES
CC#CCOCC1CO1- InChIKey
ZJUDBWRATXIYDO-UHFFFAOYSA-N- Molecular formula
- C7H10O2
- Average molar mass
- 126.15 g/mol
- Monoisotopic mass
- 126.06807956
Names & identifiers
- Preferred name
- Propane, 1-(2-butynyloxy)-2,3-epoxy-
- IUPAC
- 2-(but-2-ynoxymethyl)oxirane
Names & synonyms
Propane, 1-(2-butynyloxy)-2,3-epoxy-42468-64-4NSC-1534272-(but-2-ynoxymethyl)oxirane2-{[(But-2-yn-1-yl)oxy]methyl}oxiraneNSC153427DTXSID50962841DTXSID80302776Oxirane, [(2-butynyloxy)methyl]-2-[(2-Butyn-1-yloxy)methyl]oxirane8QN5P67484Oxirane, 2-[(2-butyn-1-yloxy)methyl]-
Database identifiers
- CAS
42468-64-4、42997-25-1- PubChem CID
- 290306
- DTXSID
DTXSID50962841- UNII
- 8QN5P67484
Properties
Computed structural properties
- XLogP
- 0.4
- Topological polar surface area
- 21.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 139
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…