2-(Diethylamino)ethyl laurate
Basic information
- CAS
16070-12-5- Standard SMILES
CCCCCCCCCCCC(=O)OCCN(CC)CC- InChIKey
UNWMSJSGBWRHNY-UHFFFAOYSA-N- Molecular formula
- C18H37NO2
- Average molar mass
- 299.5 g/mol
- Monoisotopic mass
- 299.28242942
Names & identifiers
- Preferred name
- 2-(Diethylamino)ethyl laurate
- IUPAC
- 2-(diethylamino)ethyl dodecanoate
- English name
- 2-(diethylamino)ethyl laurate
- Molecular formula
- C18H37NO2
- Molecular weight
- 299.49
Names & synonyms
2-(Diethylamino)ethyl laurate16070-12-52-(DIETHYLAMINO)ETHYL DODECANOATEEINECS 240-218-5C4FV47YR2SSCHEMBL4245473CHEMBL1275765DTXSID00166973UNWMSJSGBWRHNY-UHFFFAOYSA-NDodecanoic acid, 2-(diethylamino)ethyl esterNS00025236Dodecanoic acid 2-(diethylamino)ethyl ester
Database identifiers
- CAS
16070-12-5- PubChem CID
- 85269
- DTXSID
DTXSID00166973- ChEMBL
CHEMBL1275765- UNII
- C4FV47YR2S
- EC Number
- 240-218-5
- Nikkaji
- J286.805I
Properties
Computed structural properties
- XLogP
- 6
- Topological polar surface area
- 29.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 16
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 227
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Compound notes
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