Basic information
- CAS
65732-23-2- Standard SMILES
C#C[C@@]12O[C@@H]1CCC[C@H]2C- InChIKey
UPHNSGUFMPNWCQ-HLTSFMKQSA-N- Molecular formula
- C9H12O
- Average molar mass
- 136.19 g/mol
Names & identifiers
- Preferred name
- (1R,2R,6R)-1-ethynyl-2-methyl-7-oxabicyclo[4.1.0]heptane
- IUPAC
- (1R,2R,6R)-1-ethynyl-2-methyl-7-oxabicyclo[4.1.0]heptane
- English name
- 7-Oxabicyclo[4.1.0]heptane, 1-ethynyl-2-methyl-, (1alpha,2alpha,6alpha)- (9CI)
- Molecular formula
- C9H12O
- Molecular weight
- 136.19
Names & synonyms
65732-23-27-Oxabicyclo[4.1.0]heptane, 1-ethynyl-2-methyl-, (1alpha,2alpha,6alpha)- (9CI)
Database identifiers
- CAS
65732-23-2
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 12.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 200
Chemistry & industry
Suppliers1 total
CHEMSTEP[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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