Basic information
- CAS
155190-60-6- Standard SMILES
C#C[C@]1(O)C=C[C@]1(C)OC- InChIKey
DDNFPJVEJTVAPO-YUMQZZPRSA-N- Molecular formula
- C8H10O2
- Average molar mass
- 138.16 g/mol
Names & identifiers
- Preferred name
- CID 45079294
- IUPAC
- (1R,4S)-1-ethynyl-4-methoxy-4-methylcyclobut-2-en-1-ol
- English name
- 2-Cyclobuten-1-ol, 1-ethynyl-4-methoxy-4-methyl-, cis- (9CI)
- Molecular formula
- C8H10O2
- Molecular weight
- 138.16
Names & synonyms
2-Cyclobuten-1-ol, 1-ethynyl-4-methoxy-4-methyl-, cis- (9CI)
Database identifiers
- CAS
155190-60-6
Properties
Computed structural properties
- XLogP
- 0
- Topological polar surface area
- 29.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 223
Chemistry & industry
Suppliers1 total
CHEMSTEP[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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