2-[3-(9,9-dimethylfluoren-2-yl)-5-(9H-fluoren-1-yl)phenyl]-4,6-diphenyl-1,3,5-triazine;2-[3-(9,9-dimethylfluoren-2-yl)-5-phenylphenyl]-4,6-diphenyl-1,3,5-triazine;2,4-diphenyl-6-(3-phenyl-5-spiro[cyclopentane-1,9'-fluorene]-2'-ylphenyl)-1,3,5-triazine

C135H99N9 — CID 159653437

IUPAC2-[3-(9,9-dimethylfluoren-2-yl)-5-(9H-fluoren-1-yl)phenyl]-4,6-diphenyl-1,3,5-triazine;2-[3-(9,9-dimethylfluoren-2-yl)-5-phenylphenyl]-4,6-diphenyl-1,3,5-triazine;2,4-diphenyl-6-(3-phenyl-5-spiro[cyclopentane-1,9'-fluorene]-2'-ylphenyl)-1,3,5-triazine
SMILESCC1(C)c2ccccc2-c2ccc(-c3cc(-c4ccccc4)cc(-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)c3)cc21.CC1(C)c2ccccc2-c2ccc(-c3cc(-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)cc(-c4cccc5c4Cc4ccccc4-5)c3)cc21.c1ccc(-c2cc(-c3ccc4c(c3)C3(CCCC3)c3ccccc3-4)cc(-c3nc(-c4ccccc4)nc(-c4ccccc4)n3)c2)cc1
InChIInChI=1S/C49H35N3.C44H33N3.C42H31N3/c1-49(2)44-23-12-11-20-41(44)42-25-24-33(30-45(42)49)35-26-36(39-21-13-22-40-38-19-10-9-18-34(38)29-43(39)40)28-37(27-35)48-51-46(31-14-5-3-6-15-31)50-47(52-48)32-16-7-4-8-17-32;1-4-14-30(15-5-1)34-26-35(33-22-23-38-37-20-10-11-21-39(37)44(40(38)29-33)24-12-13-25-44)28-36(27-34)43-46-41(31-16-6-2-7-17-31)45-42(47-43)32-18-8-3-9-19-32;1-42(2)37-21-13-12-20-35(37)36-23-22-31(27-38(36)42)33-24-32(28-14-6-3-7-15-28)25-34(26-33)41-44-39(29-16-8-4-9-17-29)43-40(45-41)30-18-10-5-11-19-30/h3-28,30H,29H2,1-2H3;1-11,14-23,26-29H,12-13,24-25H2;3-27H,1-2H3
InChIKeyMRWDIIKIHLAJRS-UHFFFAOYSA-N
MW1847.34 g/mol
LogP33.64
Rot. Bonds15

About 2-[3-(9,9-dimethylfluoren-2-yl)-5-(9H-fluoren-1-yl)phenyl]-4,6-diphenyl-1,3,5-triazine;2-[3-(9,9-dimethylfluoren-2-yl)-5-phenylphenyl]-4,6-diphenyl-1,3,5-triazine;2,4-diphenyl-6-(3-phenyl-5-spiro[cyclopentane-1,9'-fluorene]-2'-ylphenyl)-1,3,5-triazine

2-[3-(9,9-dimethylfluoren-2-yl)-5-(9H-fluoren-1-yl)phenyl]-4,6-diphenyl-1,3,5-triazine;2-[3-(9,9-dimethylfluoren-2-yl)-5-phenylphenyl]-4,6-diphenyl-1,3,5-triazine;2,4-diphenyl-6-(3-phenyl-5-spiro[cyclopentane-1,9'-fluorene]-2'-ylphenyl)-1,3,5-triazine (PubChem CID 159653437) has the molecular formula C135H99N9 and a molecular weight of 1847.34 g/mol. Its IUPAC name is 2-[3-(9,9-dimethylfluoren-2-yl)-5-(9H-fluoren-1-yl)phenyl]-4,6-diphenyl-1,3,5-triazine;2-[3-(9,9-dimethylfluoren-2-yl)-5-phenylphenyl]-4,6-diphenyl-1,3,5-triazine;2,4-diphenyl-6-(3-phenyl-5-spiro[cyclopentane-1,9'-fluorene]-2'-ylphenyl)-1,3,5-triazine.

Molecular Properties

Compound Name2-[3-(9,9-dimethylfluoren-2-yl)-5-(9H-fluoren-1-yl)phenyl]-4,6-diphenyl-1,3,5-triazine;2-[3-(9,9-dimethylfluoren-2-yl)-5-phenylphenyl]-4,6-diphenyl-1,3,5-triazine;2,4-diphenyl-6-(3-phenyl-5-spiro[cyclopentane-1,9'-fluorene]-2'-ylphenyl)-1,3,5-triazine
PubChem CID159653437
Molecular FormulaC135H99N9
Molecular Weight1847.34 g/mol
Exact Mass1845.80
IUPAC Name2-[3-(9,9-dimethylfluoren-2-yl)-5-(9H-fluoren-1-yl)phenyl]-4,6-diphenyl-1,3,5-triazine;2-[3-(9,9-dimethylfluoren-2-yl)-5-phenylphenyl]-4,6-diphenyl-1,3,5-triazine;2,4-diphenyl-6-(3-phenyl-5-spiro[cyclopentane-1,9'-fluorene]-2'-ylphenyl)-1,3,5-triazine
SMILESCC1(C)c2ccccc2-c2ccc(-c3cc(-c4ccccc4)cc(-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)c3)cc21.CC1(C)c2ccccc2-c2ccc(-c3cc(-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)cc(-c4cccc5c4Cc4ccccc4-5)c3)cc21.c1ccc(-c2cc(-c3ccc4c(c3)C3(CCCC3)c3ccccc3-4)cc(-c3nc(-c4ccccc4)nc(-c4ccccc4)n3)c2)cc1
InChIInChI=1S/C49H35N3.C44H33N3.C42H31N3/c1-49(2)44-23-12-11-20-41(44)42-25-24-33(30-45(42)49)35-26-36(39-21-13-22-40-38-19-10-9-18-34(38)29-43(39)40)28-37(27-35)48-51-46(31-14-5-3-6-15-31)50-47(52-48)32-16-7-4-8-17-32;1-4-14-30(15-5-1)34-26-35(33-22-23-38-37-20-10-11-21-39(37)44(40(38)29-33)24-12-13-25-44)28-36(27-34)43-46-41(31-16-6-2-7-17-31)45-42(47-43)32-18-8-3-9-19-32;1-42(2)37-21-13-12-20-35(37)36-23-22-31(27-38(36)42)33-24-32(28-14-6-3-7-15-28)25-34(26-33)41-44-39(29-16-8-4-9-17-29)43-40(45-41)30-18-10-5-11-19-30/h3-28,30H,29H2,1-2H3;1-11,14-23,26-29H,12-13,24-25H2;3-27H,1-2H3
InChIKeyMRWDIIKIHLAJRS-UHFFFAOYSA-N
XLogP33.64
TPSA116.01 Ų
H-Bond Donors
H-Bond Acceptors9
Rotatable Bonds15
Heavy Atoms144
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001847.34
LogP ≤ 533.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 109

Analyze 2-[3-(9,9-dimethylfluoren-2-yl)-5-(9H-fluoren-1-yl)phenyl]-4,6-diphenyl-1,3,5-triazine;2-[3-(9,9-dimethylfluoren-2-yl)-5-phenylphenyl]-4,6-diphenyl-1,3,5-triazine;2,4-diphenyl-6-(3-phenyl-5-spiro[cyclopentane-1,9'-fluorene]-2'-ylphenyl)-1,3,5-triazine with MolForge

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Related Compounds

2-(9,9-dimethylfluoren-2-yl)-4-[3-(9H-fluoren-1-yl)-5-(4-phenylphenyl)phenyl]-6-phenyl-1,3,5-triazine
CID 118685337
2-[3-(9,9-dimethylfluoren-2-yl)-5-(9H-fluoren-1-yl)phenyl]-4,6-diphenyl-1,3,5-triazine;methane
CID 161494558
2-(9,9-dimethylfluoren-2-yl)-4-phenyl-6-[3-phenyl-5-(8-phenyl-9H-fluoren-1-yl)phenyl]-1,3,5-triazine;2-phenyl-4-(3-phenylphenyl)-6-[3-phenyl-5-(8-phenyl-9H-fluoren-1-yl)phenyl]-1,3,5-triazine;2-phenyl-4-(4-phenylphenyl)-6-[3-phenyl-5-(8-phenyl-9H-fluoren-1-yl)phenyl]-1,3,5-triazine
CID 158720930
2-(9,9-dimethylfluoren-2-yl)-4-phenyl-6-[3-[8-(3-phenylphenyl)-9H-fluoren-1-yl]phenyl]-1,3,5-triazine;2-(9,9-dimethylfluoren-2-yl)-4-phenyl-6-[3-[8-(4-phenylphenyl)-9H-fluoren-1-yl]phenyl]-1,3,5-triazine
CID 157184888
2-(9,9-dimethylfluoren-2-yl)-4-phenyl-6-(8-phenyl-9H-fluoren-3-yl)-1,3,5-triazine
CID 118685410
2-[3,5-bis(9,9-dimethylfluoren-2-yl)phenyl]-4,6-bis(4-phenylphenyl)-1,3,5-triazine
CID 126609528
2-[3,5-bis(9H-fluoren-1-yl)phenyl]-4,6-bis(9,9-dimethylfluoren-3-yl)-1,3,5-triazine
CID 161346190
2,4-diphenyl-6-[3-[3-(4-spiro[cyclohexane-1,9'-fluorene]-2'-ylphenyl)phenyl]phenyl]-1,3,5-triazine
CID 160674553
2-phenyl-4-(3-phenylphenyl)-6-[3-[4-(4-spiro[cyclohexane-1,9'-fluorene]-2'-ylphenyl)phenyl]phenyl]-1,3,5-triazine
CID 159514358
2-phenyl-4-(4-phenylphenyl)-6-[3-[3-(4-spiro[cyclohexane-1,9'-fluorene]-2'-ylphenyl)phenyl]phenyl]-1,3,5-triazine
CID 159556137
2-[3-[6-(9,9-dimethylfluoren-2-yl)-9H-fluoren-3-yl]phenyl]-4,6-diphenyl-1,3,5-triazine
CID 121241565
2-[3-[5-(9,9-dimethylfluoren-2-yl)-9H-fluoren-1-yl]phenyl]-4,6-diphenyl-1,3,5-triazine
CID 121241569

Frequently Asked Questions

What is the IUPAC name of 2-[3-(9,9-dimethylfluoren-2-yl)-5-(9H-fluoren-1-yl)phenyl]-4,6-diphenyl-1,3,5-triazine;2-[3-(9,9-dimethylfluoren-2-yl)-5-phenylphenyl]-4,6-diphenyl-1,3,5-triazine;2,4-diphenyl-6-(3-phenyl-5-spiro[cyclopentane-1,9'-fluorene]-2'-ylphenyl)-1,3,5-triazine?
The IUPAC name of 2-[3-(9,9-dimethylfluoren-2-yl)-5-(9H-fluoren-1-yl)phenyl]-4,6-diphenyl-1,3,5-triazine;2-[3-(9,9-dimethylfluoren-2-yl)-5-phenylphenyl]-4,6-diphenyl-1,3,5-triazine;2,4-diphenyl-6-(3-phenyl-5-spiro[cyclopentane-1,9'-fluorene]-2'-ylphenyl)-1,3,5-triazine (CID 159653437) is 2-[3-(9,9-dimethylfluoren-2-yl)-5-(9H-fluoren-1-yl)phenyl]-4,6-diphenyl-1,3,5-triazine;2-[3-(9,9-dimethylfluoren-2-yl)-5-phenylphenyl]-4,6-diphenyl-1,3,5-triazine;2,4-diphenyl-6-(3-phenyl-5-spiro[cyclopentane-1,9'-fluorene]-2'-ylphenyl)-1,3,5-triazine.
What is the SMILES notation for 2-[3-(9,9-dimethylfluoren-2-yl)-5-(9H-fluoren-1-yl)phenyl]-4,6-diphenyl-1,3,5-triazine;2-[3-(9,9-dimethylfluoren-2-yl)-5-phenylphenyl]-4,6-diphenyl-1,3,5-triazine;2,4-diphenyl-6-(3-phenyl-5-spiro[cyclopentane-1,9'-fluorene]-2'-ylphenyl)-1,3,5-triazine?
The canonical SMILES for 2-[3-(9,9-dimethylfluoren-2-yl)-5-(9H-fluoren-1-yl)phenyl]-4,6-diphenyl-1,3,5-triazine;2-[3-(9,9-dimethylfluoren-2-yl)-5-phenylphenyl]-4,6-diphenyl-1,3,5-triazine;2,4-diphenyl-6-(3-phenyl-5-spiro[cyclopentane-1,9'-fluorene]-2'-ylphenyl)-1,3,5-triazine is CC1(C)c2ccccc2-c2ccc(-c3cc(-c4ccccc4)cc(-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)c3)cc21.CC1(C)c2ccccc2-c2ccc(-c3cc(-c4nc(-c5ccccc5)nc(-c5ccccc5)n4)cc(-c4cccc5c4Cc4ccccc4-5)c3)cc21.c1ccc(-c2cc(-c3ccc4c(c3)C3(CCCC3)c3ccccc3-4)cc(-c3nc(-c4ccccc4)nc(-c4ccccc4)n3)c2)cc1.
What is the InChIKey of 2-[3-(9,9-dimethylfluoren-2-yl)-5-(9H-fluoren-1-yl)phenyl]-4,6-diphenyl-1,3,5-triazine;2-[3-(9,9-dimethylfluoren-2-yl)-5-phenylphenyl]-4,6-diphenyl-1,3,5-triazine;2,4-diphenyl-6-(3-phenyl-5-spiro[cyclopentane-1,9'-fluorene]-2'-ylphenyl)-1,3,5-triazine?
The InChIKey is MRWDIIKIHLAJRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C49H35N3.C44H33N3.C42H31N3/c1-49(2)44-23-12-11-20-41(44)42-25-24-33(30-45(42)49)35-26-36(39-21-13-22-40-38-19-10-9-18-34(38)29-43(39)40)28-37(27-35)48-51-46(31-14-5-3-6-15-31)50-47(52-48)32-16-7-4-8-17-32;1-4-14-30(15-5-1)34-26-35(33-22-23-38-37-20-10-11-21-39(37)44(40(38)29-33)24-12-13-25-44)28-36(27-34)43-46-41(31-16-6-2-7-17-31)45-42(47-43)32-18-8-3-9-19-32;1-42(2)37-21-13-12-20-35(37)36-23-22-31(27-38(36)42)33-24-32(28-14-6-3-7-15-28)25-34(26-33)41-44-39(29-16-8-4-9-17-29)43-40(45-41)30-18-10-5-11-19-30/h3-28,30H,29H2,1-2H3;1-11,14-23,26-29H,12-13,24-25H2;3-27H,1-2H3.
What are the key properties of 2-[3-(9,9-dimethylfluoren-2-yl)-5-(9H-fluoren-1-yl)phenyl]-4,6-diphenyl-1,3,5-triazine;2-[3-(9,9-dimethylfluoren-2-yl)-5-phenylphenyl]-4,6-diphenyl-1,3,5-triazine;2,4-diphenyl-6-(3-phenyl-5-spiro[cyclopentane-1,9'-fluorene]-2'-ylphenyl)-1,3,5-triazine?
2-[3-(9,9-dimethylfluoren-2-yl)-5-(9H-fluoren-1-yl)phenyl]-4,6-diphenyl-1,3,5-triazine;2-[3-(9,9-dimethylfluoren-2-yl)-5-phenylphenyl]-4,6-diphenyl-1,3,5-triazine;2,4-diphenyl-6-(3-phenyl-5-spiro[cyclopentane-1,9'-fluorene]-2'-ylphenyl)-1,3,5-triazine has a molecular weight of 1847.34 g/mol, XLogP of 33.64, 15 rotatable bonds, 0 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(9,9-dimethylfluoren-2-yl)-5-(9H-fluoren-1-yl)phenyl]-4,6-diphenyl-1,3,5-triazine;2-[3-(9,9-dimethylfluoren-2-yl)-5-phenylphenyl]-4,6-diphenyl-1,3,5-triazine;2,4-diphenyl-6-(3-phenyl-5-spiro[cyclopentane-1,9'-fluorene]-2'-ylphenyl)-1,3,5-triazine is sourced from PubChem (CID 159653437), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).