7-chlorofuro[3,2-b]pyridine

• ChemBase ID: 63482
• Molecular Formular: C7H4ClNO
• Molecular Mass: 153.56576
• Monoisotopic Mass: 152.99814143
• SMILES: c1oc2c(nccc2Cl)c1
• Canonical SMILES: Clc1ccnc2c1occ2
• InChI: InChI=1S/C7H4ClNO/c8-5-1-3-9-6-2-4-10-7(5)6/h1-4H
• InChIKey: JVRFEXMVMBMREK-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 7-chlorofuro[3,2-b]pyridine
• IUPAC Traditional name: 7-chlorofuro[3,2-b]pyridine
• Synonyms: 7-Chlorofuro[3,2-b]pyridine

Database IDs

• CAS Number: 182691-75-4
• MDL Number: MFCD15143870
• PubChem SID: 162029221
• PubChem CID: 10558822

CALCULATED PROPERTIES

• H Acceptors: 1
• H Donor: 0
• LogD (pH = 5.5): 1.9040961
• LogD (pH = 7.4): 1.9045856
• Log P: 1.9045918
• Molar Refractivity: 37.175 cm^3
• Polarizability: 15.713869 Å^3
• Polar Surface Area: 26.03 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

PROPERTIES

Safety Information

• Storage Warning: IRRITANT
• TSCA Listed: false

Product Information

• Purity: >95%