potassium (phenylformamido)olate

• ChemBase ID: 251309
• Molecular Formular: C7H6KNO2
• Molecular Mass: 175.22634
• Monoisotopic Mass: 175.00356012
• SMILES: C(=O)(N[O-])c1ccccc1.[K+]
• Canonical SMILES: [O-]NC(=O)c1ccccc1.[K+]
• InChI: InChI=1S/C7H6NO2.K/c9-7(8-10)6-4-2-1-3-5-6;/h1-5H,(H-,8,9,10);/q-1;+1
• InChIKey: KNALIXDZFLAJJD-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: potassium (phenylformamido)olate
• IUPAC Traditional name: potassium benzohydroxamate
• Synonyms: potassium (phenylformamido)olate

Database IDs

• CAS Number: 32685-16-8
• MDL Number: MFCD00019945
• PubChem SID: 164307219
• PubChem CID: 3808331

CALCULATED PROPERTIES

• Acid pKa: 9.650895
• H Acceptors: 2
• H Donor: 1
• LogD (pH = 5.5): 0.8206738
• LogD (pH = 7.4): 0.8182846
• Log P: 0.8207044
• Molar Refractivity: 35.7793 cm^3
• Polarizability: 13.523507 Å^3
• Polar Surface Area: 52.16 Å^2
• Rotatable Bonds: 1
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Hydrophobicity(logP): 0.137

Product Information

• Purity: null%