2-chlorophenazine

• ChemBase ID: 288766
• Molecular Formular: C12H7ClN2
• Molecular Mass: 214.65038
• Monoisotopic Mass: 214.02977591
• SMILES: Clc1cc2nc3ccccc3nc2cc1
• Canonical SMILES: Clc1ccc2c(c1)nc1c(n2)cccc1
• InChI: InChI=1S/C12H7ClN2/c13-8-5-6-11-12(7-8)15-10-4-2-1-3-9(10)14-11/h1-7H
• InChIKey: LYZDGXICDJEHAD-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 2-chlorophenazine
• IUPAC Traditional name: 2-chlorophenazine
• Synonyms: 2-Chlorophenazine

Database IDs

• CAS Number: 1137-69-5
• PubChem SID: 180674297
• PubChem CID: 345310

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 0
• LogD (pH = 5.5): 3.664212
• LogD (pH = 7.4): 3.6642992
• Log P: 3.6643004
• Molar Refractivity: 57.9614 cm^3
• Polarizability: 25.508282 Å^3
• Polar Surface Area: 25.78 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

PROPERTIES

Product Information

• Purity: 95+%