6-(9,9-dimethylfluoren-2-yl)-2-[7-[7-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-3-phenylpyridine

C71H57N — CID 58881124

IUPAC6-(9,9-dimethylfluoren-2-yl)-2-[7-[7-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-3-phenylpyridine
SMILESCC1(C)c2ccccc2-c2ccc(-c3ccc4c(c3)C(C)(C)c3cc(-c5ccc6c(c5)C(C)(C)c5cc(-c7nc(-c8ccc9c(c8)C(C)(C)c8ccccc8-9)ccc7-c7ccccc7)ccc5-6)ccc3-4)cc21
InChIInChI=1S/C71H57N/c1-68(2)58-20-14-12-18-50(58)52-28-22-43(36-60(52)68)44-23-29-54-55-30-24-45(38-62(55)70(5,6)61(54)37-44)46-25-31-56-57-33-27-48(41-65(57)71(7,8)63(56)39-46)67-49(42-16-10-9-11-17-42)34-35-66(72-67)47-26-32-53-51-19-13-15-21-59(51)69(3,4)64(53)40-47/h9-41H,1-8H3
InChIKeyCRNVPMXEQYLSOK-UHFFFAOYSA-N
MW924.24 g/mol
LogP18.64
Rot. Bonds5

About 6-(9,9-dimethylfluoren-2-yl)-2-[7-[7-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-3-phenylpyridine

6-(9,9-dimethylfluoren-2-yl)-2-[7-[7-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-3-phenylpyridine (PubChem CID 58881124) has the molecular formula C71H57N and a molecular weight of 924.24 g/mol. Its IUPAC name is 6-(9,9-dimethylfluoren-2-yl)-2-[7-[7-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-3-phenylpyridine.

Molecular Properties

Compound Name6-(9,9-dimethylfluoren-2-yl)-2-[7-[7-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-3-phenylpyridine
PubChem CID58881124
Molecular FormulaC71H57N
Molecular Weight924.24 g/mol
Exact Mass923.45
IUPAC Name6-(9,9-dimethylfluoren-2-yl)-2-[7-[7-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-3-phenylpyridine
SMILESCC1(C)c2ccccc2-c2ccc(-c3ccc4c(c3)C(C)(C)c3cc(-c5ccc6c(c5)C(C)(C)c5cc(-c7nc(-c8ccc9c(c8)C(C)(C)c8ccccc8-9)ccc7-c7ccccc7)ccc5-6)ccc3-4)cc21
InChIInChI=1S/C71H57N/c1-68(2)58-20-14-12-18-50(58)52-28-22-43(36-60(52)68)44-23-29-54-55-30-24-45(38-62(55)70(5,6)61(54)37-44)46-25-31-56-57-33-27-48(41-65(57)71(7,8)63(56)39-46)67-49(42-16-10-9-11-17-42)34-35-66(72-67)47-26-32-53-51-19-13-15-21-59(51)69(3,4)64(53)40-47/h9-41H,1-8H3
InChIKeyCRNVPMXEQYLSOK-UHFFFAOYSA-N
XLogP18.64
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms72
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500924.24
LogP ≤ 518.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2-(9,9-dimethylfluoren-2-yl)-6-[7-[7-[6-(9,9-dimethylfluoren-2-yl)-2-pyridinyl]-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]pyridine
CID 58881225
2-[4-[4-[9,9-dimethyl-7-(2-phenylphenyl)fluoren-2-yl]phenyl]phenyl]-9,9-dimethyl-7-(2-phenylphenyl)fluorene
CID 58880971
2,9-bis(9,9-dimethylfluoren-2-yl)-1,10-phenanthroline
CID 59297216
2-[3-(9,9-dimethylfluoren-3-yl)phenyl]-5,5-dimethylindeno[1,2-b]pyridine
CID 66594001
4-(9,9-dimethylfluoren-2-yl)-2,6-diphenylpyrimidine
CID 139366503
2-[9,9-dimethyl-7-(2-phenylphenyl)fluoren-2-yl]-7-[9,9-dimethyl-7-(3-phenylphenyl)fluoren-2-yl]-9,9-dimethylfluorene
CID 58881198
2-[9,9-dimethyl-7-(2-phenylphenyl)fluoren-2-yl]-7-(2,5-diphenylphenyl)-9,9-dimethylfluorene
CID 58881189
2-(9,9-dimethylfluoren-2-yl)-5-phenylpyridine
CID 59859383
2-[4-(9,9-dimethylfluoren-2-yl)phenyl]-4,6-diphenylpyrimidine
CID 121450738
2,4-bis[3-[3-(9,9-dimethylfluoren-2-yl)phenyl]phenyl]-6-phenyl-1,3,5-triazine
CID 118530501
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

Frequently Asked Questions

What is the IUPAC name of 6-(9,9-dimethylfluoren-2-yl)-2-[7-[7-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-3-phenylpyridine?
The IUPAC name of 6-(9,9-dimethylfluoren-2-yl)-2-[7-[7-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-3-phenylpyridine (CID 58881124) is 6-(9,9-dimethylfluoren-2-yl)-2-[7-[7-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-3-phenylpyridine.
What is the SMILES notation for 6-(9,9-dimethylfluoren-2-yl)-2-[7-[7-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-3-phenylpyridine?
The canonical SMILES for 6-(9,9-dimethylfluoren-2-yl)-2-[7-[7-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-3-phenylpyridine is CC1(C)c2ccccc2-c2ccc(-c3ccc4c(c3)C(C)(C)c3cc(-c5ccc6c(c5)C(C)(C)c5cc(-c7nc(-c8ccc9c(c8)C(C)(C)c8ccccc8-9)ccc7-c7ccccc7)ccc5-6)ccc3-4)cc21.
What is the InChIKey of 6-(9,9-dimethylfluoren-2-yl)-2-[7-[7-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-3-phenylpyridine?
The InChIKey is CRNVPMXEQYLSOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C71H57N/c1-68(2)58-20-14-12-18-50(58)52-28-22-43(36-60(52)68)44-23-29-54-55-30-24-45(38-62(55)70(5,6)61(54)37-44)46-25-31-56-57-33-27-48(41-65(57)71(7,8)63(56)39-46)67-49(42-16-10-9-11-17-42)34-35-66(72-67)47-26-32-53-51-19-13-15-21-59(51)69(3,4)64(53)40-47/h9-41H,1-8H3.
What are the key properties of 6-(9,9-dimethylfluoren-2-yl)-2-[7-[7-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-3-phenylpyridine?
6-(9,9-dimethylfluoren-2-yl)-2-[7-[7-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-3-phenylpyridine has a molecular weight of 924.24 g/mol, XLogP of 18.64, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(9,9-dimethylfluoren-2-yl)-2-[7-[7-(9,9-dimethylfluoren-2-yl)-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-3-phenylpyridine is sourced from PubChem (CID 58881124), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).