5H,7H-indolo[2,3-b]carbazole

• ChemBase ID: 286818
• Molecular Formular: C18H12N2
• Molecular Mass: 256.30128
• Monoisotopic Mass: 256.10004839
• SMILES: c12[nH]c3c(cccc3)c1cc1c([nH]c3c1cccc3)c2
• Canonical SMILES: c1ccc2c(c1)[nH]c1c2cc2c(c1)[nH]c1c2cccc1
• InChI: InChI=1S/C18H12N2/c1-3-7-15-11(5-1)13-9-14-12-6-2-4-8-16(12)20-18(14)10-17(13)19-15/h1-10,19-20H
• InChIKey: UVHIWKCVGUMHNB-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 5H,7H-indolo[2,3-b]carbazole
• IUPAC Traditional name: 5H,7H-indolo[2,3-b]carbazole
• Synonyms: 5,7-Dihydroindolo[2,3-b]carbazole

Database IDs

• CAS Number: 111296-90-3
• PubChem SID: 180672349
• PubChem CID: 10332633

CALCULATED PROPERTIES

• Acid pKa: 14.305104
• H Acceptors: 0
• H Donor: 2
• LogD (pH = 5.5): 4.2085257
• LogD (pH = 7.4): 4.2085257
• Log P: 4.2085257
• Molar Refractivity: 80.8864 cm^3
• Polarizability: 36.30177 Å^3
• Polar Surface Area: 31.58 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

PROPERTIES

Product Information

• Purity: 95+%