2,4-bis(4-phenylphenyl)-6-spiro[benzo[a]fluorene-11,9'-fluorene]-3-yl-1,3,5-triazine;2-(11,11-dimethylbenzo[a]fluoren-4-yl)-4,6-dinaphthalen-2-yl-1,3,5-triazine;2-(11,11-dimethylbenzo[a]fluoren-1-yl)-4-naphthalen-1-yl-6-phenyl-1,3,5-triazine;methane

C137H95N9 — CID 158325771

IUPAC2,4-bis(4-phenylphenyl)-6-spiro[benzo[a]fluorene-11,9'-fluorene]-3-yl-1,3,5-triazine;2-(11,11-dimethylbenzo[a]fluoren-4-yl)-4,6-dinaphthalen-2-yl-1,3,5-triazine;2-(11,11-dimethylbenzo[a]fluoren-1-yl)-4-naphthalen-1-yl-6-phenyl-1,3,5-triazine;methane
SMILESC.CC1(C)c2ccccc2-c2ccc3c(-c4nc(-c5ccc6ccccc6c5)nc(-c5ccc6ccccc6c5)n4)cccc3c21.CC1(C)c2ccccc2-c2ccc3cccc(-c4nc(-c5ccccc5)nc(-c5cccc6ccccc56)n4)c3c21.c1ccc(-c2ccc(-c3nc(-c4ccc(-c5ccccc5)cc4)nc(-c4ccc5c6c(ccc5c4)-c4ccccc4C64c5ccccc5-c5ccccc54)n3)cc2)cc1
InChIInChI=1S/C56H35N3.C42H29N3.C38H27N3.CH4/c1-3-13-36(14-4-1)38-23-27-40(28-24-38)53-57-54(41-29-25-39(26-30-41)37-15-5-2-6-16-37)59-55(58-53)43-32-33-44-42(35-43)31-34-48-47-19-9-12-22-51(47)56(52(44)48)49-20-10-7-17-45(49)46-18-8-11-21-50(46)56;1-42(2)37-17-8-7-14-33(37)35-23-22-32-34(38(35)42)15-9-16-36(32)41-44-39(30-20-18-26-10-3-5-12-28(26)24-30)43-40(45-41)31-21-19-27-11-4-6-13-29(27)25-31;1-38(2)32-21-9-8-18-28(32)29-23-22-25-16-11-20-31(33(25)34(29)38)37-40-35(26-13-4-3-5-14-26)39-36(41-37)30-19-10-15-24-12-6-7-17-27(24)30;/h1-35H;3-25H,1-2H3;3-23H,1-2H3;1H4
InChIKeyGPJQGWWNMZDDMP-UHFFFAOYSA-N
MW1867.33 g/mol
LogP34.46
Rot. Bonds11

About 2,4-bis(4-phenylphenyl)-6-spiro[benzo[a]fluorene-11,9'-fluorene]-3-yl-1,3,5-triazine;2-(11,11-dimethylbenzo[a]fluoren-4-yl)-4,6-dinaphthalen-2-yl-1,3,5-triazine;2-(11,11-dimethylbenzo[a]fluoren-1-yl)-4-naphthalen-1-yl-6-phenyl-1,3,5-triazine;methane

2,4-bis(4-phenylphenyl)-6-spiro[benzo[a]fluorene-11,9'-fluorene]-3-yl-1,3,5-triazine;2-(11,11-dimethylbenzo[a]fluoren-4-yl)-4,6-dinaphthalen-2-yl-1,3,5-triazine;2-(11,11-dimethylbenzo[a]fluoren-1-yl)-4-naphthalen-1-yl-6-phenyl-1,3,5-triazine;methane (PubChem CID 158325771) has the molecular formula C137H95N9 and a molecular weight of 1867.33 g/mol. Its IUPAC name is 2,4-bis(4-phenylphenyl)-6-spiro[benzo[a]fluorene-11,9'-fluorene]-3-yl-1,3,5-triazine;2-(11,11-dimethylbenzo[a]fluoren-4-yl)-4,6-dinaphthalen-2-yl-1,3,5-triazine;2-(11,11-dimethylbenzo[a]fluoren-1-yl)-4-naphthalen-1-yl-6-phenyl-1,3,5-triazine;methane.

Molecular Properties

Compound Name2,4-bis(4-phenylphenyl)-6-spiro[benzo[a]fluorene-11,9'-fluorene]-3-yl-1,3,5-triazine;2-(11,11-dimethylbenzo[a]fluoren-4-yl)-4,6-dinaphthalen-2-yl-1,3,5-triazine;2-(11,11-dimethylbenzo[a]fluoren-1-yl)-4-naphthalen-1-yl-6-phenyl-1,3,5-triazine;methane
PubChem CID158325771
Molecular FormulaC137H95N9
Molecular Weight1867.33 g/mol
Exact Mass1865.77
IUPAC Name2,4-bis(4-phenylphenyl)-6-spiro[benzo[a]fluorene-11,9'-fluorene]-3-yl-1,3,5-triazine;2-(11,11-dimethylbenzo[a]fluoren-4-yl)-4,6-dinaphthalen-2-yl-1,3,5-triazine;2-(11,11-dimethylbenzo[a]fluoren-1-yl)-4-naphthalen-1-yl-6-phenyl-1,3,5-triazine;methane
SMILESC.CC1(C)c2ccccc2-c2ccc3c(-c4nc(-c5ccc6ccccc6c5)nc(-c5ccc6ccccc6c5)n4)cccc3c21.CC1(C)c2ccccc2-c2ccc3cccc(-c4nc(-c5ccccc5)nc(-c5cccc6ccccc56)n4)c3c21.c1ccc(-c2ccc(-c3nc(-c4ccc(-c5ccccc5)cc4)nc(-c4ccc5c6c(ccc5c4)-c4ccccc4C64c5ccccc5-c5ccccc54)n3)cc2)cc1
InChIInChI=1S/C56H35N3.C42H29N3.C38H27N3.CH4/c1-3-13-36(14-4-1)38-23-27-40(28-24-38)53-57-54(41-29-25-39(26-30-41)37-15-5-2-6-16-37)59-55(58-53)43-32-33-44-42(35-43)31-34-48-47-19-9-12-22-51(47)56(52(44)48)49-20-10-7-17-45(49)46-18-8-11-21-50(46)56;1-42(2)37-17-8-7-14-33(37)35-23-22-32-34(38(35)42)15-9-16-36(32)41-44-39(30-20-18-26-10-3-5-12-28(26)24-30)43-40(45-41)31-21-19-27-11-4-6-13-29(27)25-31;1-38(2)32-21-9-8-18-28(32)29-23-22-25-16-11-20-31(33(25)34(29)38)37-40-35(26-13-4-3-5-14-26)39-36(41-37)30-19-10-15-24-12-6-7-17-27(24)30;/h1-35H;3-25H,1-2H3;3-23H,1-2H3;1H4
InChIKeyGPJQGWWNMZDDMP-UHFFFAOYSA-N
XLogP34.46
TPSA116.01 Ų
H-Bond Donors
H-Bond Acceptors9
Rotatable Bonds11
Heavy Atoms146
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001867.33
LogP ≤ 534.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 109

Analyze 2,4-bis(4-phenylphenyl)-6-spiro[benzo[a]fluorene-11,9'-fluorene]-3-yl-1,3,5-triazine;2-(11,11-dimethylbenzo[a]fluoren-4-yl)-4,6-dinaphthalen-2-yl-1,3,5-triazine;2-(11,11-dimethylbenzo[a]fluoren-1-yl)-4-naphthalen-1-yl-6-phenyl-1,3,5-triazine;methane with MolForge

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Related Compounds

2-(11,11-diphenylbenzo[a]fluoren-2-yl)-4-naphthalen-2-yl-6-phenyl-1,3,5-triazine;2-(11,11-diphenylbenzo[a]fluoren-3-yl)-4-naphthalen-1-yl-6-phenyl-1,3,5-triazine;2-(11,11-diphenylbenzo[a]fluoren-2-yl)-4-phenyl-6-(4-phenylphenyl)-1,3,5-triazine
CID 160936600
2-[4-(11,11-dimethylbenzo[a]fluoren-3-yl)naphthalen-1-yl]-4,6-diphenyl-1,3,5-triazine;2-[4-(11,11-dimethylbenzo[a]fluoren-3-yl)naphthalen-2-yl]-4-phenyl-6-(4-phenylphenyl)-1,3,5-triazine;2-[4-(11,11-dimethylbenzo[a]fluoren-4-yl)phenyl]-4-(9,9-diphenylfluoren-2-yl)-6-phenyl-1,3,5-triazine
CID 161010787
2-[4-(11,11-dimethylbenzo[a]fluoren-3-yl)naphthalen-2-yl]-4-phenyl-6-(4-phenylphenyl)-1,3,5-triazine
CID 155465824
2-(9,9-dimethylfluoren-2-yl)-4-phenyl-6-spiro[benzo[a]fluorene-11,9'-fluorene]-3-yl-1,3,5-triazine
CID 155465480
2-chrysen-4-yl-4-(9,9-dimethylfluoren-2-yl)-6-phenyl-1,3,5-triazine;2-(4-chrysen-4-ylnaphthalen-1-yl)-4,6-dinaphthalen-2-yl-1,3,5-triazine;2-chrysen-4-yl-4-phenanthren-2-yl-6-phenyl-1,3,5-triazine
CID 167686287
2-[4-(9,9-dimethylfluoren-1-yl)naphthalen-1-yl]-4,6-dinaphthalen-2-yl-1,3,5-triazine
CID 118427208
2-(11,11-dimethylbenzo[a]fluoren-3-yl)-4,6-dinaphthalen-1-ylpyrimidine
CID 155465661
2-(7,7-dimethylbenzo[c]fluoren-4-yl)-4,6-dinaphthalen-2-yl-1,3,5-triazine;2-(7,7-dimethylbenzo[c]fluoren-3-yl)-4-naphthalen-1-yl-6-naphthalen-2-yl-1,3,5-triazine;2-(7,7-dimethylbenzo[c]fluoren-1-yl)-4-naphthalen-1-yl-6-phenyl-1,3,5-triazine;2-(7,7-dimethylbenzo[c]fluoren-2-yl)-4-naphthalen-1-yl-6-phenyl-1,3,5-triazine
CID 159292618
2-(11,11-dimethylbenzo[b]fluoren-6-yl)-4-naphthalen-2-yl-6-phenyl-1,3,5-triazine;2-(11,11-dimethylbenzo[b]fluoren-7-yl)-4-naphthalen-2-yl-6-phenyl-1,3,5-triazine;2-(11,11-dimethylbenzo[b]fluoren-8-yl)-4-naphthalen-1-yl-6-phenyl-1,3,5-triazine;2-(11,11-dimethylbenzo[b]fluoren-8-yl)-4-phenyl-6-(4-phenylphenyl)-1,3,5-triazine;2-(11,11-dimethylbenzo[b]fluoren-9-yl)-4-phenyl-6-(4-phenylphenyl)-1,3,5-triazine
CID 157383875
2-(9,9-dimethylfluoren-2-yl)-4-phenyl-6-picen-1-yl-1,3,5-triazine
CID 167087730
2-[4-[4-(11,11-diphenylbenzo[a]fluoren-3-yl)naphthalen-1-yl]phenyl]-4-naphthalen-2-yl-6-phenyl-1,3,5-triazine
CID 155465924
2,4-diphenyl-6-(3-spiro[fluorene-9,12'-pentacyclo[11.8.0.02,11.04,9.014,19]henicosa-1(13),2,4,6,8,10,14(19),15,17,20-decaene]-17'-ylphenyl)-1,3,5-triazine
CID 137494788

Frequently Asked Questions

What is the IUPAC name of 2,4-bis(4-phenylphenyl)-6-spiro[benzo[a]fluorene-11,9'-fluorene]-3-yl-1,3,5-triazine;2-(11,11-dimethylbenzo[a]fluoren-4-yl)-4,6-dinaphthalen-2-yl-1,3,5-triazine;2-(11,11-dimethylbenzo[a]fluoren-1-yl)-4-naphthalen-1-yl-6-phenyl-1,3,5-triazine;methane?
The IUPAC name of 2,4-bis(4-phenylphenyl)-6-spiro[benzo[a]fluorene-11,9'-fluorene]-3-yl-1,3,5-triazine;2-(11,11-dimethylbenzo[a]fluoren-4-yl)-4,6-dinaphthalen-2-yl-1,3,5-triazine;2-(11,11-dimethylbenzo[a]fluoren-1-yl)-4-naphthalen-1-yl-6-phenyl-1,3,5-triazine;methane (CID 158325771) is 2,4-bis(4-phenylphenyl)-6-spiro[benzo[a]fluorene-11,9'-fluorene]-3-yl-1,3,5-triazine;2-(11,11-dimethylbenzo[a]fluoren-4-yl)-4,6-dinaphthalen-2-yl-1,3,5-triazine;2-(11,11-dimethylbenzo[a]fluoren-1-yl)-4-naphthalen-1-yl-6-phenyl-1,3,5-triazine;methane.
What is the SMILES notation for 2,4-bis(4-phenylphenyl)-6-spiro[benzo[a]fluorene-11,9'-fluorene]-3-yl-1,3,5-triazine;2-(11,11-dimethylbenzo[a]fluoren-4-yl)-4,6-dinaphthalen-2-yl-1,3,5-triazine;2-(11,11-dimethylbenzo[a]fluoren-1-yl)-4-naphthalen-1-yl-6-phenyl-1,3,5-triazine;methane?
The canonical SMILES for 2,4-bis(4-phenylphenyl)-6-spiro[benzo[a]fluorene-11,9'-fluorene]-3-yl-1,3,5-triazine;2-(11,11-dimethylbenzo[a]fluoren-4-yl)-4,6-dinaphthalen-2-yl-1,3,5-triazine;2-(11,11-dimethylbenzo[a]fluoren-1-yl)-4-naphthalen-1-yl-6-phenyl-1,3,5-triazine;methane is C.CC1(C)c2ccccc2-c2ccc3c(-c4nc(-c5ccc6ccccc6c5)nc(-c5ccc6ccccc6c5)n4)cccc3c21.CC1(C)c2ccccc2-c2ccc3cccc(-c4nc(-c5ccccc5)nc(-c5cccc6ccccc56)n4)c3c21.c1ccc(-c2ccc(-c3nc(-c4ccc(-c5ccccc5)cc4)nc(-c4ccc5c6c(ccc5c4)-c4ccccc4C64c5ccccc5-c5ccccc54)n3)cc2)cc1.
What is the InChIKey of 2,4-bis(4-phenylphenyl)-6-spiro[benzo[a]fluorene-11,9'-fluorene]-3-yl-1,3,5-triazine;2-(11,11-dimethylbenzo[a]fluoren-4-yl)-4,6-dinaphthalen-2-yl-1,3,5-triazine;2-(11,11-dimethylbenzo[a]fluoren-1-yl)-4-naphthalen-1-yl-6-phenyl-1,3,5-triazine;methane?
The InChIKey is GPJQGWWNMZDDMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C56H35N3.C42H29N3.C38H27N3.CH4/c1-3-13-36(14-4-1)38-23-27-40(28-24-38)53-57-54(41-29-25-39(26-30-41)37-15-5-2-6-16-37)59-55(58-53)43-32-33-44-42(35-43)31-34-48-47-19-9-12-22-51(47)56(52(44)48)49-20-10-7-17-45(49)46-18-8-11-21-50(46)56;1-42(2)37-17-8-7-14-33(37)35-23-22-32-34(38(35)42)15-9-16-36(32)41-44-39(30-20-18-26-10-3-5-12-28(26)24-30)43-40(45-41)31-21-19-27-11-4-6-13-29(27)25-31;1-38(2)32-21-9-8-18-28(32)29-23-22-25-16-11-20-31(33(25)34(29)38)37-40-35(26-13-4-3-5-14-26)39-36(41-37)30-19-10-15-24-12-6-7-17-27(24)30;/h1-35H;3-25H,1-2H3;3-23H,1-2H3;1H4.
What are the key properties of 2,4-bis(4-phenylphenyl)-6-spiro[benzo[a]fluorene-11,9'-fluorene]-3-yl-1,3,5-triazine;2-(11,11-dimethylbenzo[a]fluoren-4-yl)-4,6-dinaphthalen-2-yl-1,3,5-triazine;2-(11,11-dimethylbenzo[a]fluoren-1-yl)-4-naphthalen-1-yl-6-phenyl-1,3,5-triazine;methane?
2,4-bis(4-phenylphenyl)-6-spiro[benzo[a]fluorene-11,9'-fluorene]-3-yl-1,3,5-triazine;2-(11,11-dimethylbenzo[a]fluoren-4-yl)-4,6-dinaphthalen-2-yl-1,3,5-triazine;2-(11,11-dimethylbenzo[a]fluoren-1-yl)-4-naphthalen-1-yl-6-phenyl-1,3,5-triazine;methane has a molecular weight of 1867.33 g/mol, XLogP of 34.46, 11 rotatable bonds, 0 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-bis(4-phenylphenyl)-6-spiro[benzo[a]fluorene-11,9'-fluorene]-3-yl-1,3,5-triazine;2-(11,11-dimethylbenzo[a]fluoren-4-yl)-4,6-dinaphthalen-2-yl-1,3,5-triazine;2-(11,11-dimethylbenzo[a]fluoren-1-yl)-4-naphthalen-1-yl-6-phenyl-1,3,5-triazine;methane is sourced from PubChem (CID 158325771), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).