2,4,6-Tri(carbazol-9-yl)-5-chlorobenzene-1,3-dicarbonitrile

Catalog Number

ACM1469704617

CAS

1469704-61-7

Synonyms

3CzClIPN

IUPAC Name

2,4,6-tri(carbazol-9-yl)-5-chlorobenzene-1,3-dicarbonitrile

Molecular Weight

658.15

Molecular Formula

C44H24ClN5

Canonical SMILES

C1=CC=C2C(=C1)C3=CC=CC=C3N2C4=C(C(=C(C(=C4C#N)N5C6=CC=CC=C6C7=CC=CC=C75)Cl)N8C9=CC=CC=C9C1=CC=CC=C18)C#N

InChI

InChI=1S/C44H24ClN5/c45-41-43(49-37-21-9-3-15-29(37)30-16-4-10-22-38(30)49)33(25-46)42(48-35-19-7-1-13-27(35)28-14-2-8-20-36(28)48)34(26-47)44(41)50-39-23-11-5-17-31(39)32-18-6-12-24-40(32)50/h1-24H

InChI Key

AETFKBFYWGEUOV-UHFFFAOYSA-N

Melting Point

>300 °C

Purity

97%+

Appearance

Powder or crystals

• Catalog Number: ACM1469704617
• CAS: 1469704-61-7
• Synonyms: 3CzClIPN
• IUPAC Name: 2,4,6-tri(carbazol-9-yl)-5-chlorobenzene-1,3-dicarbonitrile
• Molecular Weight: 658.15
• Molecular Formula: C44H24ClN5
• Canonical SMILES: C1=CC=C2C(=C1)C3=CC=CC=C3N2C4=C(C(=C(C(=C4C#N)N5C6=CC=CC=C6C7=CC=CC=C75)Cl)N8C9=CC=CC=C9C1=CC=CC=C18)C#N
• InChI: InChI=1S/C44H24ClN5/c45-41-43(49-37-21-9-3-15-29(37)30-16-4-10-22-38(30)49)33(25-46)42(48-35-19-7-1-13-27(35)28-14-2-8-20-36(28)48)34(26-47)44(41)50-39-23-11-5-17-31(39)32-18-6-12-24-40(32)50/h1-24H
• InChI Key: AETFKBFYWGEUOV-UHFFFAOYSA-N
• Melting Point: >300 °C
• Purity: 97%+
• Appearance: Powder or crystals