10-[3-[3-(3,5-diphenylphenyl)phenyl]phenyl]-12-phenyl-10,12-dihydroindeno[2,1-b]fluorene;10-[3-[3-(9H-fluoren-1-yl)phenyl]phenyl]-12-phenyl-10,12-dihydroindeno[2,1-b]fluorene

C107H72 — CID 158834334

IUPAC10-[3-[3-(3,5-diphenylphenyl)phenyl]phenyl]-12-phenyl-10,12-dihydroindeno[2,1-b]fluorene;10-[3-[3-(9H-fluoren-1-yl)phenyl]phenyl]-12-phenyl-10,12-dihydroindeno[2,1-b]fluorene
SMILESc1ccc(-c2cc(-c3ccccc3)cc(-c3cccc(-c4cccc(C5c6ccccc6-c6cc7c(cc65)C(c5ccccc5)c5ccccc5-7)c4)c3)c2)cc1.c1ccc(C2c3ccccc3-c3cc4c(cc32)C(c2cccc(-c3cccc(-c5cccc6c5Cc5ccccc5-6)c3)c2)c2ccccc2-4)cc1
InChIInChI=1S/C56H38.C51H34/c1-4-16-37(17-5-1)44-32-45(38-18-6-2-7-19-38)34-46(33-44)42-24-14-22-40(30-42)41-23-15-25-43(31-41)56-50-29-13-11-27-48(50)52-35-51-47-26-10-12-28-49(47)55(53(51)36-54(52)56)39-20-8-3-9-21-39;1-2-13-32(14-3-1)50-43-23-8-6-21-41(43)46-30-47-42-22-7-9-24-44(42)51(49(47)31-48(46)50)37-19-11-17-34(28-37)33-16-10-18-35(27-33)39-25-12-26-40-38-20-5-4-15-36(38)29-45(39)40/h1-36,55-56H;1-28,30-31,50-51H,29H2
InChIKeyIXLCLMUKSFOYFN-UHFFFAOYSA-N
MW1357.75 g/mol
LogP27.59
Rot. Bonds10

About 10-[3-[3-(3,5-diphenylphenyl)phenyl]phenyl]-12-phenyl-10,12-dihydroindeno[2,1-b]fluorene;10-[3-[3-(9H-fluoren-1-yl)phenyl]phenyl]-12-phenyl-10,12-dihydroindeno[2,1-b]fluorene

10-[3-[3-(3,5-diphenylphenyl)phenyl]phenyl]-12-phenyl-10,12-dihydroindeno[2,1-b]fluorene;10-[3-[3-(9H-fluoren-1-yl)phenyl]phenyl]-12-phenyl-10,12-dihydroindeno[2,1-b]fluorene (PubChem CID 158834334) has the molecular formula C107H72 and a molecular weight of 1357.75 g/mol. Its IUPAC name is 10-[3-[3-(3,5-diphenylphenyl)phenyl]phenyl]-12-phenyl-10,12-dihydroindeno[2,1-b]fluorene;10-[3-[3-(9H-fluoren-1-yl)phenyl]phenyl]-12-phenyl-10,12-dihydroindeno[2,1-b]fluorene.

Molecular Properties

Compound Name10-[3-[3-(3,5-diphenylphenyl)phenyl]phenyl]-12-phenyl-10,12-dihydroindeno[2,1-b]fluorene;10-[3-[3-(9H-fluoren-1-yl)phenyl]phenyl]-12-phenyl-10,12-dihydroindeno[2,1-b]fluorene
PubChem CID158834334
Molecular FormulaC107H72
Molecular Weight1357.75 g/mol
Exact Mass1356.56
IUPAC Name10-[3-[3-(3,5-diphenylphenyl)phenyl]phenyl]-12-phenyl-10,12-dihydroindeno[2,1-b]fluorene;10-[3-[3-(9H-fluoren-1-yl)phenyl]phenyl]-12-phenyl-10,12-dihydroindeno[2,1-b]fluorene
SMILESc1ccc(-c2cc(-c3ccccc3)cc(-c3cccc(-c4cccc(C5c6ccccc6-c6cc7c(cc65)C(c5ccccc5)c5ccccc5-7)c4)c3)c2)cc1.c1ccc(C2c3ccccc3-c3cc4c(cc32)C(c2cccc(-c3cccc(-c5cccc6c5Cc5ccccc5-6)c3)c2)c2ccccc2-4)cc1
InChIInChI=1S/C56H38.C51H34/c1-4-16-37(17-5-1)44-32-45(38-18-6-2-7-19-38)34-46(33-44)42-24-14-22-40(30-42)41-23-15-25-43(31-41)56-50-29-13-11-27-48(50)52-35-51-47-26-10-12-28-49(47)55(53(51)36-54(52)56)39-20-8-3-9-21-39;1-2-13-32(14-3-1)50-43-23-8-6-21-41(43)46-30-47-42-22-7-9-24-44(42)51(49(47)31-48(46)50)37-19-11-17-34(28-37)33-16-10-18-35(27-33)39-25-12-26-40-38-20-5-4-15-36(38)29-45(39)40/h1-36,55-56H;1-28,30-31,50-51H,29H2
InChIKeyIXLCLMUKSFOYFN-UHFFFAOYSA-N
XLogP27.59
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds10
Heavy Atoms107
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001357.75
LogP ≤ 527.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze 10-[3-[3-(3,5-diphenylphenyl)phenyl]phenyl]-12-phenyl-10,12-dihydroindeno[2,1-b]fluorene;10-[3-[3-(9H-fluoren-1-yl)phenyl]phenyl]-12-phenyl-10,12-dihydroindeno[2,1-b]fluorene with MolForge

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Frequently Asked Questions

What is the IUPAC name of 10-[3-[3-(3,5-diphenylphenyl)phenyl]phenyl]-12-phenyl-10,12-dihydroindeno[2,1-b]fluorene;10-[3-[3-(9H-fluoren-1-yl)phenyl]phenyl]-12-phenyl-10,12-dihydroindeno[2,1-b]fluorene?
The IUPAC name of 10-[3-[3-(3,5-diphenylphenyl)phenyl]phenyl]-12-phenyl-10,12-dihydroindeno[2,1-b]fluorene;10-[3-[3-(9H-fluoren-1-yl)phenyl]phenyl]-12-phenyl-10,12-dihydroindeno[2,1-b]fluorene (CID 158834334) is 10-[3-[3-(3,5-diphenylphenyl)phenyl]phenyl]-12-phenyl-10,12-dihydroindeno[2,1-b]fluorene;10-[3-[3-(9H-fluoren-1-yl)phenyl]phenyl]-12-phenyl-10,12-dihydroindeno[2,1-b]fluorene.
What is the SMILES notation for 10-[3-[3-(3,5-diphenylphenyl)phenyl]phenyl]-12-phenyl-10,12-dihydroindeno[2,1-b]fluorene;10-[3-[3-(9H-fluoren-1-yl)phenyl]phenyl]-12-phenyl-10,12-dihydroindeno[2,1-b]fluorene?
The canonical SMILES for 10-[3-[3-(3,5-diphenylphenyl)phenyl]phenyl]-12-phenyl-10,12-dihydroindeno[2,1-b]fluorene;10-[3-[3-(9H-fluoren-1-yl)phenyl]phenyl]-12-phenyl-10,12-dihydroindeno[2,1-b]fluorene is c1ccc(-c2cc(-c3ccccc3)cc(-c3cccc(-c4cccc(C5c6ccccc6-c6cc7c(cc65)C(c5ccccc5)c5ccccc5-7)c4)c3)c2)cc1.c1ccc(C2c3ccccc3-c3cc4c(cc32)C(c2cccc(-c3cccc(-c5cccc6c5Cc5ccccc5-6)c3)c2)c2ccccc2-4)cc1.
What is the InChIKey of 10-[3-[3-(3,5-diphenylphenyl)phenyl]phenyl]-12-phenyl-10,12-dihydroindeno[2,1-b]fluorene;10-[3-[3-(9H-fluoren-1-yl)phenyl]phenyl]-12-phenyl-10,12-dihydroindeno[2,1-b]fluorene?
The InChIKey is IXLCLMUKSFOYFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C56H38.C51H34/c1-4-16-37(17-5-1)44-32-45(38-18-6-2-7-19-38)34-46(33-44)42-24-14-22-40(30-42)41-23-15-25-43(31-41)56-50-29-13-11-27-48(50)52-35-51-47-26-10-12-28-49(47)55(53(51)36-54(52)56)39-20-8-3-9-21-39;1-2-13-32(14-3-1)50-43-23-8-6-21-41(43)46-30-47-42-22-7-9-24-44(42)51(49(47)31-48(46)50)37-19-11-17-34(28-37)33-16-10-18-35(27-33)39-25-12-26-40-38-20-5-4-15-36(38)29-45(39)40/h1-36,55-56H;1-28,30-31,50-51H,29H2.
What are the key properties of 10-[3-[3-(3,5-diphenylphenyl)phenyl]phenyl]-12-phenyl-10,12-dihydroindeno[2,1-b]fluorene;10-[3-[3-(9H-fluoren-1-yl)phenyl]phenyl]-12-phenyl-10,12-dihydroindeno[2,1-b]fluorene?
10-[3-[3-(3,5-diphenylphenyl)phenyl]phenyl]-12-phenyl-10,12-dihydroindeno[2,1-b]fluorene;10-[3-[3-(9H-fluoren-1-yl)phenyl]phenyl]-12-phenyl-10,12-dihydroindeno[2,1-b]fluorene has a molecular weight of 1357.75 g/mol, XLogP of 27.59, 10 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 10-[3-[3-(3,5-diphenylphenyl)phenyl]phenyl]-12-phenyl-10,12-dihydroindeno[2,1-b]fluorene;10-[3-[3-(9H-fluoren-1-yl)phenyl]phenyl]-12-phenyl-10,12-dihydroindeno[2,1-b]fluorene is sourced from PubChem (CID 158834334), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).