Basic information
- CAS
67210-53-1- Standard SMILES
CC(C)(COC(=O)/C=C/c1ccccc1)C[NH+]1CCOCC1.[Cl-]- InChIKey
VZLWHTIEUBPDSA-HRNDJLQDSA-N- Molecular formula
- C18H26ClNO3
- Average molar mass
- 339.9 g/mol
- Monoisotopic mass
- 339.1601214
Names & identifiers
- Preferred name
- Cinnamic acid, (2,2-dimethyl-3-morpholinopropyl) ester, hydrochloride
- IUPAC
- (2,2-dimethyl-3-morpholin-4-ium-4-ylpropyl) (E)-3-phenylprop-2-enoate chloride
Names & synonyms
CINNAMIC ACID, (2,2-DIMETHYL-3-MORPHOLINOPROPYL) ESTER, HYDROCHLORIDE67210-53-1RefChem:1081743beta,beta-Dimethyl-gamma-4-morpholinepropyl cinnamate hydrochloride2-Propenoic acid, 3-phenyl-, 2,2-dimethyl-3-(4-morpholinyl)propyl ester, hydrochloride
Database identifiers
- CAS
67210-53-1- PubChem CID
- 6435002
Properties
Computed structural properties
- Topological polar surface area
- 40 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 7
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 367
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…