2-(Diethylamino)cyclohexyl (4-propoxyphenyl)carbamate--hydrogen chloride (1/1)
Basic information
- CAS
38198-43-5- Standard SMILES
CCCOc1ccc(NC(=O)O[C@@H]2CCCC[C@H]2N(CC)CC)cc1.Cl- InChIKey
RPXXJGHFNBFIPG-STYNFMPRSA-N- Molecular formula
- C20H33ClN2O3
- Average molar mass
- 384.9 g/mol
- Monoisotopic mass
- 384.2179706
Overview
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Names & identifiers
- Preferred name
- 2-(Diethylamino)cyclohexyl (4-propoxyphenyl)carbamate--hydrogen chloride (1/1)
- IUPAC
- [(1R,2R)-2-(diethylamino)cyclohexyl] N-(4-propoxyphenyl)carbamate;hydrochloride
Names & synonyms
DTXSID50959135(1R,2R)-2-(Diethylamino)cyclohexyl (4-propoxyphenyl)carbamate--hydrogen chloride (1/1)2-(Diethylamino)cyclohexyl (4-propoxyphenyl)carbamate--hydrogen chloride (1/1)
Database identifiers
- CAS
38198-43-5- PubChem CID
- 138399366
- DTXSID
DTXSID50959135
Properties
Computed structural properties
- Topological polar surface area
- 50.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 9
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 379
Related reactions
0 records
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Compound notes
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