Basic information
- CAS
29446-94-4- Standard SMILES
CCN(CC)CCOC(=O)c1c(C)cc(N)cc1C- InChIKey
NEIBYDXRQISQCQ-UHFFFAOYSA-N- Molecular formula
- C15H24N2O2
- Average molar mass
- 264.36 g/mol
- Monoisotopic mass
- 264.18377801
Names & identifiers
- Preferred name
- Benzoic acid, 4-amino-2,6-dimethyl-, 2-(diethylamino)ethyl ester
- IUPAC
- 2-(diethylamino)ethyl 4-amino-2,6-dimethylbenzoate
Names & synonyms
2-Diethylaminoethyl 4-amino-2,6-dimethylbenzoateBRN 2123193BENZOIC ACID, 4-AMINO-2,6-DIMETHYL-, 2-(DIETHYLAMINO)ETHYL ESTER29446-94-44-Amino-2,6-dimethylbenzoic acid 2-(diethylamino)ethyl esterDTXSID701836524-14-00-01712 (Beilstein Handbook Reference)RefChem:327510DTXCID101061432-(diethylamino)ethyl 4-amino-2,6-dimethylbenzoate
Database identifiers
- CAS
29446-94-4- PubChem CID
- 34587
- DTXSID
DTXSID70183652
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 55.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 7
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 267
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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