Carbamic acid, (2,4,6-trimethylphenyl)-, 2-((diethylamino)methyl)cyclohexyl ester, monohydrochloride, trans-
Basic information
- CAS
130533-83-4- Standard SMILES
CCN(CC)C[C@@H]1CCCC[C@H]1OC(=O)Nc1c(C)cc(C)cc1C.Cl- InChIKey
WKCHVVBAHHVNPP-GRTNUQQKSA-N- Molecular formula
- C21H35ClN2O2
- Average molar mass
- 383 g/mol
- Monoisotopic mass
- 382.2387061
Names & identifiers
- Preferred name
- Carbamic acid, (2,4,6-trimethylphenyl)-, 2-((diethylamino)methyl)cyclohexyl ester, monohydrochloride, trans-
- IUPAC
- [(1R,2S)-2-(diethylaminomethyl)cyclohexyl] N-(2,4,6-trimethylphenyl)carbamate;hydrochloride
Names & synonyms
Carbamic acid, (2,4,6-trimethylphenyl)-, 2-((diethylamino)methyl)cyclohexyl ester, monohydrochloride, trans-trans-2-((Diethylamino)methyl)cyclohexyl (2,4,6-trimethylphenyl)carbamate hydrochloride130533-83-4DTXSID00156617RefChem:331823DTXCID8079108(1R,2S)-2-[(Diethylamino)methyl]cyclohexyl (2,4,6-trimethylphenyl)carbamate--hydrogen chloride (1/1)
Database identifiers
- CAS
130533-83-4- PubChem CID
- 3076243
- DTXSID
DTXSID00156617
Properties
Computed structural properties
- Topological polar surface area
- 41.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 7
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 399
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Compound notes
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