Basic information
- CAS
67049-55-2- Standard SMILES
CC(C)(COC(=O)c1ccccc1)C[NH+]1CCOCC1.[Cl-]- InChIKey
WSAZEGSMPZRNFX-UHFFFAOYSA-N- Molecular formula
- C16H24ClNO3
- Average molar mass
- 313.82 g/mol
- Monoisotopic mass
- 313.1444713
Names & identifiers
- Preferred name
- 2,2-Dimethyl-3-(morpholin-4-yl)propyl benzoate--hydrogen chloride (1/1)
- IUPAC
- (2,2-dimethyl-3-morpholin-4-ium-4-ylpropyl) benzoate chloride
Names & synonyms
67049-55-2DTXSID909860012,2-Dimethyl-3-(morpholin-4-yl)propyl benzoate--hydrogen chloride (1/1)RefChem:1059121DTXCID301413190BENZOIC ACID, (2,2-DIMETHYL-3-MORPHOLINOPROPYL) ESTER, HYDROCHLORIDEbeta,beta-Dimethyl-gamma-4-morpholinepropyl benzoate hydrochloride
Database identifiers
- CAS
67049-55-2- PubChem CID
- 49073
Properties
Computed structural properties
- Topological polar surface area
- 40 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 305
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…