2-(Dimethylamino)ethyl 3,4,5-trimethoxybenzoate
Basic information
- CAS
22775-41-3- Standard SMILES
COc1cc(C(=O)OCCN(C)C)cc(OC)c1OC- InChIKey
GUSZNZWHOZBJKH-UHFFFAOYSA-N- Molecular formula
- C14H21NO5
- Average molar mass
- 283.32 g/mol
- Monoisotopic mass
- 283.14197277
Names & identifiers
- Preferred name
- 2-(Dimethylamino)ethyl 3,4,5-trimethoxybenzoate
- IUPAC
- 2-(dimethylamino)ethyl 3,4,5-trimethoxybenzoate
Names & synonyms
ZINC4895172-(dimethylamino)ethyl 3,4,5-trimethoxybenzoateOprea1_276945DTXSID601244635MFCD03130624STK022922AKOS037478354COc1cc(cc(c1OC)OC)C(=O)OCCN(C)C22775-41-3COc1cc(cc(c1OC)OC)C(=O)OCCN(C)CClZINC0000004895172DIMETHYLAMINOETHYL345TRIMETHOXYBENZOATE
Show more names
2(DIMETHYLAMINO)ETHYL345TRIMETHOXYBENZOATECN(C)CCOC(=O)C1=CC(=C(C(=C1)OC)OC)OC2(dimethylamino)ethyl345trimethoxybenzoatehydrochloride
Database identifiers
- CAS
22775-41-3- PubChem CID
- 907567
- DTXSID
DTXSID601244635
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 57.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 8
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 283
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…