7-tert-butyl-N-[5-tert-butyl-2-[6,8-di(propan-2-yl)-6,7-dihydrodibenzofuran-4-yl]phenyl]-N-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-amine

C62H67NO — CID 174315860

About 7-tert-butyl-N-[5-tert-butyl-2-[6,8-di(propan-2-yl)-6,7-dihydrodibenzofuran-4-yl]phenyl]-N-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-amine

7-tert-butyl-N-[5-tert-butyl-2-[6,8-di(propan-2-yl)-6,7-dihydrodibenzofuran-4-yl]phenyl]-N-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-amine (PubChem CID 174315860) has the molecular formula C62H67NO and a molecular weight of 842.22 g/mol. Its IUPAC name is 7-tert-butyl-N-[5-tert-butyl-2-[6,8-di(propan-2-yl)-6,7-dihydrodibenzofuran-4-yl]phenyl]-N-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-amine.

Molecular Properties

• Compound Name: 7-tert-butyl-N-[5-tert-butyl-2-[6,8-di(propan-2-yl)-6,7-dihydrodibenzofuran-4-yl]phenyl]-N-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-amine
• PubChem CID: 174315860
• Molecular Formula: C62H67NO
• Molecular Weight: 842.22 g/mol
• Exact Mass: 841.52
• IUPAC Name: 7-tert-butyl-N-[5-tert-butyl-2-[6,8-di(propan-2-yl)-6,7-dihydrodibenzofuran-4-yl]phenyl]-N-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-amine
• SMILES: CC(C)C1=Cc2c(oc3c(-c4ccc(C(C)(C)C)cc4N(c4ccc5c(c4)C(C)(C)c4ccccc4-5)c4ccc5c(c4)C(C)(C)c4cc(C(C)(C)C)ccc4-5)cccc23)C(C(C)C)C1
• InChI: InChI=1S/C62H67NO/c1-36(2)38-30-50(37(3)4)58-51(31-38)49-20-17-19-48(57(49)64-58)47-27-23-40(60(8,9)10)33-56(47)63(41-24-28-45-43-18-15-16-21-52(43)61(11,12)54(45)34-41)42-25-29-46-44-26-22-39(59(5,6)7)32-53(44)62(13,14)55(46)35-42/h15-29,31-37,50H,30H2,1-14H3
• InChIKey: HHTOEHPVGXSGTQ-UHFFFAOYSA-N
• XLogP: 17.96
• TPSA: 16.38 Ų
• H-Bond Acceptors: 2
• Rotatable Bonds: 6
• Heavy Atoms: 64
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	842.22
LogP ≤ 5	17.96
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	2

Frequently Asked Questions

What is the IUPAC name of 7-tert-butyl-N-[5-tert-butyl-2-[6,8-di(propan-2-yl)-6,7-dihydrodibenzofuran-4-yl]phenyl]-N-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-amine?

The IUPAC name of 7-tert-butyl-N-[5-tert-butyl-2-[6,8-di(propan-2-yl)-6,7-dihydrodibenzofuran-4-yl]phenyl]-N-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-amine (CID 174315860) is 7-tert-butyl-N-[5-tert-butyl-2-[6,8-di(propan-2-yl)-6,7-dihydrodibenzofuran-4-yl]phenyl]-N-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-amine.

What is the SMILES notation for 7-tert-butyl-N-[5-tert-butyl-2-[6,8-di(propan-2-yl)-6,7-dihydrodibenzofuran-4-yl]phenyl]-N-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-amine?

The canonical SMILES for 7-tert-butyl-N-[5-tert-butyl-2-[6,8-di(propan-2-yl)-6,7-dihydrodibenzofuran-4-yl]phenyl]-N-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-amine is CC(C)C1=Cc2c(oc3c(-c4ccc(C(C)(C)C)cc4N(c4ccc5c(c4)C(C)(C)c4ccccc4-5)c4ccc5c(c4)C(C)(C)c4cc(C(C)(C)C)ccc4-5)cccc23)C(C(C)C)C1.

What is the InChIKey of 7-tert-butyl-N-[5-tert-butyl-2-[6,8-di(propan-2-yl)-6,7-dihydrodibenzofuran-4-yl]phenyl]-N-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-amine?

The InChIKey is HHTOEHPVGXSGTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C62H67NO/c1-36(2)38-30-50(37(3)4)58-51(31-38)49-20-17-19-48(57(49)64-58)47-27-23-40(60(8,9)10)33-56(47)63(41-24-28-45-43-18-15-16-21-52(43)61(11,12)54(45)34-41)42-25-29-46-44-26-22-39(59(5,6)7)32-53(44)62(13,14)55(46)35-42/h15-29,31-37,50H,30H2,1-14H3.

What are the key properties of 7-tert-butyl-N-[5-tert-butyl-2-[6,8-di(propan-2-yl)-6,7-dihydrodibenzofuran-4-yl]phenyl]-N-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-amine?

7-tert-butyl-N-[5-tert-butyl-2-[6,8-di(propan-2-yl)-6,7-dihydrodibenzofuran-4-yl]phenyl]-N-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-amine has a molecular weight of 842.22 g/mol, XLogP of 17.96, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.

Where does this data come from?

All data for 7-tert-butyl-N-[5-tert-butyl-2-[6,8-di(propan-2-yl)-6,7-dihydrodibenzofuran-4-yl]phenyl]-N-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-amine is sourced from PubChem (CID 174315860), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).