Basic information
- CAS
10367-89-2- Standard SMILES
CCN(CC)CCOC(=O)c1ccc(C)cc1- InChIKey
LDZVENZNKUFGHJ-UHFFFAOYSA-N- Molecular formula
- C14H21NO2
- Average molar mass
- 235.32 g/mol
- Monoisotopic mass
- 235.15722891
Names & identifiers
- Preferred name
- 2-(Diethylamino)ethyl 4-methylbenzoate
- IUPAC
- 2-(diethylamino)ethyl 4-methylbenzoate
- English name
- 2-(diethylamino)ethyl 4-methylbenzoate
- Molecular formula
- C14H21NO2
- Molecular weight
- 235.32204
Names & synonyms
2-(diethylamino)ethyl 4-methylbenzoatebenzoic acid, 4-methyl-, 2-(diethylamino)ethyl esterK3XSN97PNRSCHEMBL8489295SCHEMBL84892982-(Diethylamino)ethyl p-toluateSTK056520AKOS00365695210367-89-2p-Toluic acid, 2-(diethylamino)ethyl esterAO-365/34875031
Database identifiers
- CAS
10367-89-2- PubChem CID
- 214818
- UNII
- K3XSN97PNR
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 29.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 7
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 218
Chemistry & industry
Suppliers2 total
SPECS[email protected]
VITAS-BB—
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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