Basic information
- CAS
13908-21-9- Standard SMILES
CCOC(=O)C1(NC(=O)NCCCl)CCCCC1- InChIKey
YRNQNLYSXJVKEG-UHFFFAOYSA-N- Molecular formula
- C12H21ClN2O3
- Average molar mass
- 276.76 g/mol
- Monoisotopic mass
- 276.1240702
Names & identifiers
- Preferred name
- Ethyl 1-{[(2-chloroethyl)carbamoyl]amino}cyclohexane-1-carboxylate
- IUPAC
- ethyl 1-(2-chloroethylcarbamoylamino)cyclohexane-1-carboxylate
Names & synonyms
13908-21-9NSC95447DTXSID00294245Ethyl 1-{[(2-chloroethyl)carbamoyl]amino}cyclohexane-1-carboxylateNSC-95447
Database identifiers
- CAS
13908-21-9- PubChem CID
- 262113
- DTXSID
DTXSID00294245
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 67.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 291
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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