2,7-Di(1-pyrenyl)-9,9'-spirobi[9H-fluorene]

Catalog Number

ACM886456800-1

CAS

886456-80-0

Synonyms

2,7-Di-Pyrenyl-9,9-Spirobifluorene

IUPAC Name

2',7'-di(pyren-1-yl)-9,9'-spirobi[fluorene]

Molecular Weight

716.88

Molecular Formula

C57H32

Canonical SMILES

C1=CC=C2C(=C1)C3=CC=CC=C3C24C5=C(C=CC(=C5)C6=C7C=CC8=CC=CC9=C8C7=C(C=C9)C=C6)C1=C4C=C(C=C1)C1=C2C=CC3=CC=CC4=C3C2=C(C=C4)C=C1

InChI

InChI=1S/C57H32/c1-3-13-49-43(11-1)44-12-2-4-14-50(44)57(49)51-31-39(41-25-19-37-17-15-33-7-5-9-35-21-29-47(41)55(37)53(33)35)23-27-45(51)46-28-24-40(32-52(46)57)42-26-20-38-18-16-34-8-6-10-36-22-30-48(42)56(38)54(34)36/h1-32H

InChI Key

MJXRNMQMLMXICM-UHFFFAOYSA-N

Boiling Point

399 °C

Melting Point

275 °C

Purity

95%+

Appearance

Light yellow to Brown powder to crystal

Storage

Store under inert gas

MDL Number

MFCD12022456

• Catalog Number: ACM886456800-1
• CAS: 886456-80-0
• Synonyms: 2,7-Di-Pyrenyl-9,9-Spirobifluorene
• IUPAC Name: 2',7'-di(pyren-1-yl)-9,9'-spirobi[fluorene]
• Molecular Weight: 716.88
• Molecular Formula: C57H32
• Canonical SMILES: C1=CC=C2C(=C1)C3=CC=CC=C3C24C5=C(C=CC(=C5)C6=C7C=CC8=CC=CC9=C8C7=C(C=C9)C=C6)C1=C4C=C(C=C1)C1=C2C=CC3=CC=CC4=C3C2=C(C=C4)C=C1
• InChI: InChI=1S/C57H32/c1-3-13-49-43(11-1)44-12-2-4-14-50(44)57(49)51-31-39(41-25-19-37-17-15-33-7-5-9-35-21-29-47(41)55(37)53(33)35)23-27-45(51)46-28-24-40(32-52(46)57)42-26-20-38-18-16-34-8-6-10-36-22-30-48(42)56(38)54(34)36/h1-32H
• InChI Key: MJXRNMQMLMXICM-UHFFFAOYSA-N
• Boiling Point: 399 °C
• Melting Point: 275 °C
• Purity: 95%+
• Appearance: Light yellow to Brown powder to crystal
• Storage: Store under inert gas
• MDL Number: MFCD12022456