2-[9,9-dimethyl-7-[4-[4-(4-naphthalen-2-ylphenyl)phenyl]phenyl]fluoren-2-yl]-9,9-dimethyl-7-[4-[4-(4-naphthalen-2-ylphenyl)phenyl]phenyl]fluorene

C86H62 — CID 123193635

IUPAC2-[9,9-dimethyl-7-[4-[4-(4-naphthalen-2-ylphenyl)phenyl]phenyl]fluoren-2-yl]-9,9-dimethyl-7-[4-[4-(4-naphthalen-2-ylphenyl)phenyl]phenyl]fluorene
SMILESCC1(C)c2cc(-c3ccc(-c4ccc(-c5ccc(-c6ccc7ccccc7c6)cc5)cc4)cc3)ccc2-c2ccc(-c3ccc4c(c3)C(C)(C)c3cc(-c5ccc(-c6ccc(-c7ccc(-c8ccc9ccccc9c8)cc7)cc6)cc5)ccc3-4)cc21
InChIInChI=1S/C86H62/c1-85(2)81-51-73(67-33-25-63(26-34-67)59-17-13-57(14-18-59)61-21-29-65(30-22-61)71-39-37-55-9-5-7-11-69(55)49-71)41-45-77(81)79-47-43-75(53-83(79)85)76-44-48-80-78-46-42-74(52-82(78)86(3,4)84(80)54-76)68-35-27-64(28-36-68)60-19-15-58(16-20-60)62-23-31-66(32-24-62)72-40-38-56-10-6-8-12-70(56)50-72/h5-54H,1-4H3
InChIKeyPNBGMLXDFSELHK-UHFFFAOYSA-N
MW1095.44 g/mol
LogP23.61
Rot. Bonds9

About 2-[9,9-dimethyl-7-[4-[4-(4-naphthalen-2-ylphenyl)phenyl]phenyl]fluoren-2-yl]-9,9-dimethyl-7-[4-[4-(4-naphthalen-2-ylphenyl)phenyl]phenyl]fluorene

2-[9,9-dimethyl-7-[4-[4-(4-naphthalen-2-ylphenyl)phenyl]phenyl]fluoren-2-yl]-9,9-dimethyl-7-[4-[4-(4-naphthalen-2-ylphenyl)phenyl]phenyl]fluorene (PubChem CID 123193635) has the molecular formula C86H62 and a molecular weight of 1095.44 g/mol. Its IUPAC name is 2-[9,9-dimethyl-7-[4-[4-(4-naphthalen-2-ylphenyl)phenyl]phenyl]fluoren-2-yl]-9,9-dimethyl-7-[4-[4-(4-naphthalen-2-ylphenyl)phenyl]phenyl]fluorene.

Molecular Properties

Compound Name2-[9,9-dimethyl-7-[4-[4-(4-naphthalen-2-ylphenyl)phenyl]phenyl]fluoren-2-yl]-9,9-dimethyl-7-[4-[4-(4-naphthalen-2-ylphenyl)phenyl]phenyl]fluorene
PubChem CID123193635
Molecular FormulaC86H62
Molecular Weight1095.44 g/mol
Exact Mass1094.49
IUPAC Name2-[9,9-dimethyl-7-[4-[4-(4-naphthalen-2-ylphenyl)phenyl]phenyl]fluoren-2-yl]-9,9-dimethyl-7-[4-[4-(4-naphthalen-2-ylphenyl)phenyl]phenyl]fluorene
SMILESCC1(C)c2cc(-c3ccc(-c4ccc(-c5ccc(-c6ccc7ccccc7c6)cc5)cc4)cc3)ccc2-c2ccc(-c3ccc4c(c3)C(C)(C)c3cc(-c5ccc(-c6ccc(-c7ccc(-c8ccc9ccccc9c8)cc7)cc6)cc5)ccc3-4)cc21
InChIInChI=1S/C86H62/c1-85(2)81-51-73(67-33-25-63(26-34-67)59-17-13-57(14-18-59)61-21-29-65(30-22-61)71-39-37-55-9-5-7-11-69(55)49-71)41-45-77(81)79-47-43-75(53-83(79)85)76-44-48-80-78-46-42-74(52-82(78)86(3,4)84(80)54-76)68-35-27-64(28-36-68)60-19-15-58(16-20-60)62-23-31-66(32-24-62)72-40-38-56-10-6-8-12-70(56)50-72/h5-54H,1-4H3
InChIKeyPNBGMLXDFSELHK-UHFFFAOYSA-N
XLogP23.61
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds9
Heavy Atoms86
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001095.44
LogP ≤ 523.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze 2-[9,9-dimethyl-7-[4-[4-(4-naphthalen-2-ylphenyl)phenyl]phenyl]fluoren-2-yl]-9,9-dimethyl-7-[4-[4-(4-naphthalen-2-ylphenyl)phenyl]phenyl]fluorene with MolForge

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Related Compounds

2-(9,9-dimethylfluoren-2-yl)-7-[7-[7-[7-[9,9-dimethyl-7-(4-naphthalen-2-ylphenyl)fluoren-2-yl]-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluorene
CID 123392580
2-(9,9-dimethylfluoren-2-yl)-7-[9,9-dimethyl-7-[4-(4-naphthalen-2-ylphenyl)phenyl]fluoren-2-yl]-9,9-dimethylfluorene
CID 123709509
9,9-dimethyl-2-naphthalen-2-yl-7-[3-(4-phenylphenyl)phenyl]fluorene
CID 59217136
2-[9,9-dimethyl-7-(6-naphthalen-2-ylnaphthalen-2-yl)fluoren-2-yl]-9,9-dimethyl-7-(3-phenylphenyl)fluorene
CID 123207992
2-bromo-9,9-dimethyl-7-(4-naphthalen-2-ylphenyl)fluorene
CID 66667960
2-[6-(9,9-dimethylfluoren-2-yl)naphthalen-2-yl]-9,9-dimethylfluorene
CID 59133445
2-[6-[6-(9,9-dimethylfluoren-2-yl)naphthalen-2-yl]naphthalen-2-yl]-9,9-dimethylfluorene
CID 58351434
2-[9,9-dimethyl-7-[4-(4-naphthalen-1-ylphenyl)phenyl]fluoren-2-yl]-9,9-dimethyl-7-[4-(4-naphthalen-2-ylphenyl)phenyl]fluorene
CID 123907813
9,9-dimethyl-2-naphthalen-2-yl-7-[4-[(E)-2-phenylethenyl]phenyl]fluorene
CID 59217060
9-[4-(9,9-dimethyl-7-phenylfluoren-2-yl)phenyl]-10-naphthalen-2-ylanthracene
CID 59725436
6,6,12,12-tetramethyl-2-[3-(6-naphthalen-2-ylnaphthalen-2-yl)phenyl]indeno[1,2-b]fluorene
CID 140710753
2-[7-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-yl]-4,6-dinaphthalen-2-yl-1,3,5-triazine
CID 118427115

Frequently Asked Questions

What is the IUPAC name of 2-[9,9-dimethyl-7-[4-[4-(4-naphthalen-2-ylphenyl)phenyl]phenyl]fluoren-2-yl]-9,9-dimethyl-7-[4-[4-(4-naphthalen-2-ylphenyl)phenyl]phenyl]fluorene?
The IUPAC name of 2-[9,9-dimethyl-7-[4-[4-(4-naphthalen-2-ylphenyl)phenyl]phenyl]fluoren-2-yl]-9,9-dimethyl-7-[4-[4-(4-naphthalen-2-ylphenyl)phenyl]phenyl]fluorene (CID 123193635) is 2-[9,9-dimethyl-7-[4-[4-(4-naphthalen-2-ylphenyl)phenyl]phenyl]fluoren-2-yl]-9,9-dimethyl-7-[4-[4-(4-naphthalen-2-ylphenyl)phenyl]phenyl]fluorene.
What is the SMILES notation for 2-[9,9-dimethyl-7-[4-[4-(4-naphthalen-2-ylphenyl)phenyl]phenyl]fluoren-2-yl]-9,9-dimethyl-7-[4-[4-(4-naphthalen-2-ylphenyl)phenyl]phenyl]fluorene?
The canonical SMILES for 2-[9,9-dimethyl-7-[4-[4-(4-naphthalen-2-ylphenyl)phenyl]phenyl]fluoren-2-yl]-9,9-dimethyl-7-[4-[4-(4-naphthalen-2-ylphenyl)phenyl]phenyl]fluorene is CC1(C)c2cc(-c3ccc(-c4ccc(-c5ccc(-c6ccc7ccccc7c6)cc5)cc4)cc3)ccc2-c2ccc(-c3ccc4c(c3)C(C)(C)c3cc(-c5ccc(-c6ccc(-c7ccc(-c8ccc9ccccc9c8)cc7)cc6)cc5)ccc3-4)cc21.
What is the InChIKey of 2-[9,9-dimethyl-7-[4-[4-(4-naphthalen-2-ylphenyl)phenyl]phenyl]fluoren-2-yl]-9,9-dimethyl-7-[4-[4-(4-naphthalen-2-ylphenyl)phenyl]phenyl]fluorene?
The InChIKey is PNBGMLXDFSELHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C86H62/c1-85(2)81-51-73(67-33-25-63(26-34-67)59-17-13-57(14-18-59)61-21-29-65(30-22-61)71-39-37-55-9-5-7-11-69(55)49-71)41-45-77(81)79-47-43-75(53-83(79)85)76-44-48-80-78-46-42-74(52-82(78)86(3,4)84(80)54-76)68-35-27-64(28-36-68)60-19-15-58(16-20-60)62-23-31-66(32-24-62)72-40-38-56-10-6-8-12-70(56)50-72/h5-54H,1-4H3.
What are the key properties of 2-[9,9-dimethyl-7-[4-[4-(4-naphthalen-2-ylphenyl)phenyl]phenyl]fluoren-2-yl]-9,9-dimethyl-7-[4-[4-(4-naphthalen-2-ylphenyl)phenyl]phenyl]fluorene?
2-[9,9-dimethyl-7-[4-[4-(4-naphthalen-2-ylphenyl)phenyl]phenyl]fluoren-2-yl]-9,9-dimethyl-7-[4-[4-(4-naphthalen-2-ylphenyl)phenyl]phenyl]fluorene has a molecular weight of 1095.44 g/mol, XLogP of 23.61, 9 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[9,9-dimethyl-7-[4-[4-(4-naphthalen-2-ylphenyl)phenyl]phenyl]fluoren-2-yl]-9,9-dimethyl-7-[4-[4-(4-naphthalen-2-ylphenyl)phenyl]phenyl]fluorene is sourced from PubChem (CID 123193635), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).