2-(Diethylamino)-3-methoxy-3-phenylpropyl hydrogen phenylcarbonimidate
Basic information
- CAS
77944-90-2- Standard SMILES
CCN(CC)C(COC(=O)Nc1ccccc1)C(OC)c1ccccc1- InChIKey
JKDSOFUTHPCORU-UHFFFAOYSA-N- Molecular formula
- C21H28N2O3
- Average molar mass
- 356.5 g/mol
- Monoisotopic mass
- 356.20999276
Names & identifiers
- Preferred name
- 2-(Diethylamino)-3-methoxy-3-phenylpropyl hydrogen phenylcarbonimidate
- IUPAC
- [2-(diethylamino)-3-methoxy-3-phenylpropyl] N-phenylcarbamate
Names & synonyms
77944-90-2DTXSID909991362-(Diethylamino)-3-methoxy-3-phenylpropyl hydrogen phenylcarbonimidateRefChem:1061572DTXCID7014261112-Diethylamino-3-methoxy-3-phenylpropyl carbanilategamma-Phenyl-gamma-methoxy-beta-(diethylamino)propyl carbanilateCARBANILIC ACID, 2-DIETHYLAMINO-3-METHOXY-3-PHENYLPROPYL ESTER
Database identifiers
- CAS
77944-90-2- PubChem CID
- 53839
- DTXSID
DTXSID90999136- Nikkaji
- J69.522J
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 50.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 10
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 389
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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