N-ethyl-2-hydroxybenzamide

• ChemBase ID: 308052
• Molecular Formular: C9H11NO2
• Molecular Mass: 165.18914
• Monoisotopic Mass: 165.0789786
• SMILES: c1(C(=O)NCC)c(O)cccc1
• Canonical SMILES: CCNC(=O)c1ccccc1O
• InChI: InChI=1S/C9H11NO2/c1-2-10-9(12)7-5-3-4-6-8(7)11/h3-6,11H,2H2,1H3,(H,10,12)
• InChIKey: UHDKXFCUGVGVDP-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: N-ethyl-2-hydroxybenzamide
• IUPAC Traditional name: salicylethylamide
• Synonyms: N-ethyl-2-hydroxybenzamide

Database IDs

• CAS Number: 4611-42-1
• MDL Number: MFCD01684552

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 2
• LogD (pH = 5.5): 1.7499331
• LogD (pH = 7.4): 1.6865704
• Log P: 1.7508048
• Molar Refractivity: 46.7626 cm^3
• Polarizability: 17.453297 Å^3
• Polar Surface Area: 49.33 Å^2