Basic information
- CAS
91240-25-4- Standard SMILES
C#CC1(OC(N)=O)CCC(O)CC1- InChIKey
UHMWNHMWMWFGNM-UHFFFAOYSA-N- Molecular formula
- C9H13NO3
- Average molar mass
- 183.2 g/mol
Names & identifiers
- Preferred name
- (1-Ethynyl-4-hydroxycyclohexyl) carbamate
- IUPAC
- (1-ethynyl-4-hydroxycyclohexyl) carbamate
- English name
- Carbamic acid, 1-ethynyl-4-hydroxycyclohexyl ester (6CI,7CI)
- Molecular formula
- C9H13NO3
- Molecular weight
- 183.20442
Names & synonyms
Carbamic acid, 1-ethynyl-4-hydroxycyclohexyl ester (6CI,7CI)
Database identifiers
- CAS
91240-25-4
Properties
Computed structural properties
- XLogP
- 0.1
- Topological polar surface area
- 72.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 245
Chemistry & industry
Suppliers1 total
CHEMSTEP[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…