Basic information
- CAS
14925-96-3- Standard SMILES
CCCCC1OC1C- InChIKey
RAWZOXRFHKUFPX-UHFFFAOYSA-N- Molecular formula
- C7H14O
- Average molar mass
- 114.19 g/mol
- Monoisotopic mass
- 114.10446507
Names & identifiers
- Preferred name
- 2-Butyl-3-methyloxirane
- IUPAC
- 2-butyl-3-methyloxirane
- English name
- (2R,3S)-2α-Methyl-3α-butyloxirane
- Molecular formula
- C7H14O
- Molecular weight
- 114.19
Names & synonyms
2-BUTYL-3-METHYLOXIRANE14925-96-3DTXSID80933600RefChem:258027DTXCID901362258cis-2,3-Epoxyheptane(2R,3S)-2alpha-Methyl-3alpha-butyloxiraneSCHEMBL51211SCHEMBL7689986SCHEMBL76932772,3-Epoxyheptane2-Methyl-3-butyloxirane
Show more names
2β-Butyl-3β-methyloxiraneOxirane, 2-butyl-3-methyl-(2S)-2β-Methyl-3β-butyloxirane(2R,3S)-2α-Methyl-3α-butyloxirane
Database identifiers
- CAS
14925-96-3- PubChem CID
- 26970
- DTXSID
DTXSID80933600- Nikkaji
- J99.915F
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
Physicochemical properties
- Boiling point
- 135 °C · 135 °C
- Density
- 0.846 · 0.846±0.06 g/cm3(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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