Basic information
- Standard SMILES
CCN(CC)C(=O)COC(=O)c1ccc(O)cc1- InChIKey
HTAGMOFPOLPIOR-UHFFFAOYSA-N- Molecular formula
- C13H17NO4
- Average molar mass
- 251.28 g/mol
Names & identifiers
- Preferred name
- 2-(Diethylamino)-2-oxoethyl 4-hydroxybenzoate
- IUPAC
- [2-(diethylamino)-2-oxoethyl] 4-hydroxybenzoate
Names & synonyms
MLS0001106192-(diethylamino)-2-oxoethyl 4-hydroxybenzoateSMR000106548[2-(diethylamino)-2-oxoethyl] 4-hydroxybenzoateSCHEMBL9796885CHEMBL1340679BDBM68659cid_2299102HTAGMOFPOLPIOR-UHFFFAOYSA-NHMS2360A22STK380847AKOS005450225
Show more names
ST50892728(N,N-diethylcarbamoyl)methyl 4-hydroxybenzoateAB00109481-01AL-281/15328185SR-01000236395SR-01000236395-12-(4-HYDROXYBENZOYLOXY)-N,N-DIETHYLACETAMIDE4-hydroxybenzoic acid [2-(diethylamino)-2-oxoethyl] ester
Database identifiers
- PubChem CID
- 2299102
- ChEMBL
CHEMBL1340679
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 66.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 281
Related reactions
2 records
Compound notes
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