potassium naphthalen-2-yl sulfate

• ChemBase ID: 102293
• Molecular Formular: C10H7KO4S
• Molecular Mass: 262.32348
• Monoisotopic Mass: 261.97021138
• SMILES: [K+].[O-]S(=O)(=O)Oc1ccc2ccccc2c1
• Canonical SMILES: [O-]S(=O)(=O)Oc1ccc2c(c1)cccc2.[K+]
• InChI: InChI=1S/C10H8O4S.K/c11-15(12,13)14-10-6-5-8-3-1-2-4-9(8)7-10;/h1-7H,(H,11,12,13);/q;+1/p-1
• InChIKey: SKROFUUKJBLLKJ-UHFFFAOYSA-M

NAMES AND DATABASE IDS

Names

• IUPAC name: potassium naphthalen-2-yl sulfate
• IUPAC Traditional name: potassium naphthalen-2-yl sulfate; potassium ion naphthalen-2-yl sulfate
• Synonyms: 2-Naphthol hydrogen sulfate potassium salt; 2-Naphthyl sulfate potassium salt; POTASSIUM 2-NAPHTHYL SULFATE; β-NAPHTHYL SULFATE POTASSIUM SALT; 2-萘基硫酸钾盐

Database IDs

• CAS Number: 1733-89-7
• EC Number: 217-072-6
• MDL Number: MFCD00004059
• PubChem SID: 162088736
• PubChem CID: 2724416

CALCULATED PROPERTIES

• Acid pKa: -1.7807347
• H Acceptors: 3
• H Donor: 0
• LogD (pH = 5.5): -0.1925495
• LogD (pH = 7.4): -0.19255482
• Log P: 2.1838439
• Molar Refractivity: 53.3592 cm^3
• Polarizability: 23.002169 Å^3
• Polar Surface Area: 66.43 Å^2
• Rotatable Bonds: 2
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Apperance: Powder
• Melting Point: >300°C

Safety Information

• Storage Condition: 0°C
• TSCA Listed: 是

Product Information

• Purity: 98%

DETAILS

MP Biomedicals - 02100997

Potassium Salt
Substrate for sulfatases