9-(4-tert-butylphenyl)-2,7-dimethyl-9-(4-methylphenyl)fluorene

C32H32 — CID 58371098

IUPAC9-(4-tert-butylphenyl)-2,7-dimethyl-9-(4-methylphenyl)fluorene
SMILESCc1ccc(C2(c3ccc(C(C)(C)C)cc3)c3cc(C)ccc3-c3ccc(C)cc32)cc1
InChIInChI=1S/C32H32/c1-21-7-11-25(12-8-21)32(26-15-13-24(14-16-26)31(4,5)6)29-19-22(2)9-17-27(29)28-18-10-23(3)20-30(28)32/h7-20H,1-6H3
InChIKeyINFKJVLZXMCKTQ-UHFFFAOYSA-N
MW416.61 g/mol
LogP8.27
Rot. Bonds2

About 9-(4-tert-butylphenyl)-2,7-dimethyl-9-(4-methylphenyl)fluorene

9-(4-tert-butylphenyl)-2,7-dimethyl-9-(4-methylphenyl)fluorene (PubChem CID 58371098) has the molecular formula C32H32 and a molecular weight of 416.61 g/mol. Its IUPAC name is 9-(4-tert-butylphenyl)-2,7-dimethyl-9-(4-methylphenyl)fluorene.

Molecular Properties

Compound Name9-(4-tert-butylphenyl)-2,7-dimethyl-9-(4-methylphenyl)fluorene
PubChem CID58371098
Molecular FormulaC32H32
Molecular Weight416.61 g/mol
Exact Mass416.25
IUPAC Name9-(4-tert-butylphenyl)-2,7-dimethyl-9-(4-methylphenyl)fluorene
SMILESCc1ccc(C2(c3ccc(C(C)(C)C)cc3)c3cc(C)ccc3-c3ccc(C)cc32)cc1
InChIInChI=1S/C32H32/c1-21-7-11-25(12-8-21)32(26-15-13-24(14-16-26)31(4,5)6)29-19-22(2)9-17-27(29)28-18-10-23(3)20-30(28)32/h7-20H,1-6H3
InChIKeyINFKJVLZXMCKTQ-UHFFFAOYSA-N
XLogP8.27
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500416.61
LogP ≤ 58.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

1-N,4-N-bis(4-tert-butyl-2,6-dimethylphenyl)-4-N-(4-tert-butylphenyl)-1-N-[4-[2,7-dimethyl-9-(4-methylphenyl)fluoren-9-yl]phenyl]benzene-1,4-diamine
CID 59480532
1-N,4-N-bis(4-tert-butyl-2,6-dimethylphenyl)-1-N-[4-(4-tert-butylphenyl)phenyl]-4-N-[4-[2,7-dimethyl-9-(4-methylphenyl)fluoren-9-yl]phenyl]benzene-1,4-diamine
CID 59480578
12,12-bis(4-tert-butylphenyl)-2,6,6-trimethylindeno[1,2-b]fluorene
CID 163875744
9-(3,5-dimethylphenyl)-2,7-dimethyl-9-(4-methylphenyl)fluorene
CID 158311989
9-(4-methoxyphenyl)-2,7-dimethyl-9-(4-methylphenyl)fluorene
CID 59982767
2,4-bis(4-tert-butylphenyl)-6-[4-[9-(4-hexylphenyl)-2,7-dimethylfluoren-9-yl]phenyl]-1,3,5-triazine
CID 58412099
4-[4-(4-tert-butyl-N-(4-tert-butylphenyl)anilino)phenyl]-N-[4-[4-(4-tert-butyl-N-(4-tert-butylphenyl)anilino)phenyl]phenyl]-N-[4-[2,7-dimethyl-9-(4-methylphenyl)fluoren-9-yl]phenyl]aniline;2,7-dimethyl-9,9-dioctylfluorene
CID 157085258
4-tert-butyl-N-[4-[4-[4-[4-(4-tert-butyl-N-(4-tert-butyl-2,6-dimethylphenyl)anilino)phenyl]-N-[4-[2,7-dimethyl-9-(4-methylphenyl)fluoren-9-yl]phenyl]anilino]phenyl]phenyl]-N-(4-tert-butylphenyl)-2,6-dimethylaniline;N-[4-[4-[4-[4-(4-tert-butyl-N-naphthalen-2-ylanilino)phenyl]-N-[4-[2,7-dimethyl-9-(4-methylphenyl)fluoren-9-yl]phenyl]anilino]phenyl]phenyl]-N-(4-tert-butylphenyl)naphthalen-2-amine
CID 159675939
4-(4-tert-butylphenyl)-N-[4-[9-(4-hexylphenyl)-2,7-dimethylfluoren-9-yl]phenyl]-N-[4-[7,9,9-tris(4-hexylphenyl)fluoren-2-yl]phenyl]aniline
CID 58556150
4-tert-butyl-N-[4-[4-(4-tert-butyl-N-(4-tert-butyl-2,6-dimethylphenyl)anilino)phenyl]phenyl]-N-[4-[9-(4-hexylphenyl)-2,7-dimethylfluoren-9-yl]phenyl]-2,6-dimethylaniline
CID 140553755
2-tert-butyl-9,9-difluoro-7-methylfluorene;ethane
CID 157036733
4-tert-butyl-N-[4-[4-[4-[4-(4-tert-butyl-N-(4-tert-butyl-2,6-dimethylphenyl)anilino)phenyl]-N-[4-[9-(4-hexylphenyl)-2,7-dimethylfluoren-9-yl]phenyl]anilino]phenyl]phenyl]-N-(4-tert-butylphenyl)-2,6-dimethylaniline
CID 140553747

Frequently Asked Questions

What is the IUPAC name of 9-(4-tert-butylphenyl)-2,7-dimethyl-9-(4-methylphenyl)fluorene?
The IUPAC name of 9-(4-tert-butylphenyl)-2,7-dimethyl-9-(4-methylphenyl)fluorene (CID 58371098) is 9-(4-tert-butylphenyl)-2,7-dimethyl-9-(4-methylphenyl)fluorene.
What is the SMILES notation for 9-(4-tert-butylphenyl)-2,7-dimethyl-9-(4-methylphenyl)fluorene?
The canonical SMILES for 9-(4-tert-butylphenyl)-2,7-dimethyl-9-(4-methylphenyl)fluorene is Cc1ccc(C2(c3ccc(C(C)(C)C)cc3)c3cc(C)ccc3-c3ccc(C)cc32)cc1.
What is the InChIKey of 9-(4-tert-butylphenyl)-2,7-dimethyl-9-(4-methylphenyl)fluorene?
The InChIKey is INFKJVLZXMCKTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H32/c1-21-7-11-25(12-8-21)32(26-15-13-24(14-16-26)31(4,5)6)29-19-22(2)9-17-27(29)28-18-10-23(3)20-30(28)32/h7-20H,1-6H3.
What are the key properties of 9-(4-tert-butylphenyl)-2,7-dimethyl-9-(4-methylphenyl)fluorene?
9-(4-tert-butylphenyl)-2,7-dimethyl-9-(4-methylphenyl)fluorene has a molecular weight of 416.61 g/mol, XLogP of 8.27, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(4-tert-butylphenyl)-2,7-dimethyl-9-(4-methylphenyl)fluorene is sourced from PubChem (CID 58371098), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).