9,9-bis(4-methylphenyl)fluorene;9-butyl-9-propylfluorene;9,9-diethylfluorene;bis(9,9-dimethylfluorene);9,9-diphenylfluorene;1-methylnaphthalene;2-methylnaphthalene;nonakis(2-methylpropane);toluene;tris(triphenylene)

C252H280 — CID 157491370

IUPAC9,9-bis(4-methylphenyl)fluorene;9-butyl-9-propylfluorene;9,9-diethylfluorene;bis(9,9-dimethylfluorene);9,9-diphenylfluorene;1-methylnaphthalene;2-methylnaphthalene;nonakis(2-methylpropane);toluene;tris(triphenylene)
SMILESCC(C)C.CC(C)C.CC(C)C.CC(C)C.CC(C)C.CC(C)C.CC(C)C.CC(C)C.CC(C)C.CC1(C)c2ccccc2-c2ccccc21.CC1(C)c2ccccc2-c2ccccc21.CCC1(CC)c2ccccc2-c2ccccc21.CCCCC1(CCC)c2ccccc2-c2ccccc21.Cc1ccc(C2(c3ccc(C)cc3)c3ccccc3-c3ccccc32)cc1.Cc1ccc2ccccc2c1.Cc1cccc2ccccc12.Cc1ccccc1.Cc1ccccc1.Cc1ccccc1.c1ccc(C2(c3ccccc3)c3ccccc3-c3ccccc32)cc1.c1ccc2c(c1)c1ccccc1c1ccccc21.c1ccc2c(c1)c1ccccc1c1ccccc21.c1ccc2c(c1)c1ccccc1c1ccccc21
InChIInChI=1S/C27H22.C25H18.C20H24.3C18H12.C17H18.2C15H14.2C11H10.3C7H8.9C4H10/c1-19-11-15-21(16-12-19)27(22-17-13-20(2)14-18-22)25-9-5-3-7-23(25)24-8-4-6-10-26(24)27;1-3-11-19(12-4-1)25(20-13-5-2-6-14-20)23-17-9-7-15-21(23)22-16-8-10-18-24(22)25;1-3-5-15-20(14-4-2)18-12-8-6-10-16(18)17-11-7-9-13-19(17)20;3*1-2-8-14-13(7-1)15-9-3-4-11-17(15)18-12-6-5-10-16(14)18;1-3-17(4-2)15-11-7-5-9-13(15)14-10-6-8-12-16(14)17;2*1-15(2)13-9-5-3-7-11(13)12-8-4-6-10-14(12)15;1-9-5-4-7-10-6-2-3-8-11(9)10;1-9-6-7-10-4-2-3-5-11(10)8-9;3*1-7-5-3-2-4-6-7;9*1-4(2)3/h3-18H,1-2H3;1-18H;6-13H,3-5,14-15H2,1-2H3;3*1-12H;5-12H,3-4H2,1-2H3;2*3-10H,1-2H3;2*2-8H,1H3;3*2-6H,1H3;9*4H,1-3H3
InChIKeyBXHVIBMPZHCAJR-UHFFFAOYSA-N
MW3309.01 g/mol
LogP74.10
Rot. Bonds11

About 9,9-bis(4-methylphenyl)fluorene;9-butyl-9-propylfluorene;9,9-diethylfluorene;bis(9,9-dimethylfluorene);9,9-diphenylfluorene;1-methylnaphthalene;2-methylnaphthalene;nonakis(2-methylpropane);toluene;tris(triphenylene)

9,9-bis(4-methylphenyl)fluorene;9-butyl-9-propylfluorene;9,9-diethylfluorene;bis(9,9-dimethylfluorene);9,9-diphenylfluorene;1-methylnaphthalene;2-methylnaphthalene;nonakis(2-methylpropane);toluene;tris(triphenylene) (PubChem CID 157491370) has the molecular formula C252H280 and a molecular weight of 3309.01 g/mol. Its IUPAC name is 9,9-bis(4-methylphenyl)fluorene;9-butyl-9-propylfluorene;9,9-diethylfluorene;bis(9,9-dimethylfluorene);9,9-diphenylfluorene;1-methylnaphthalene;2-methylnaphthalene;nonakis(2-methylpropane);toluene;tris(triphenylene).

Molecular Properties

Compound Name9,9-bis(4-methylphenyl)fluorene;9-butyl-9-propylfluorene;9,9-diethylfluorene;bis(9,9-dimethylfluorene);9,9-diphenylfluorene;1-methylnaphthalene;2-methylnaphthalene;nonakis(2-methylpropane);toluene;tris(triphenylene)
PubChem CID157491370
Molecular FormulaC252H280
Molecular Weight3309.01 g/mol
Exact Mass3306.19
IUPAC Name9,9-bis(4-methylphenyl)fluorene;9-butyl-9-propylfluorene;9,9-diethylfluorene;bis(9,9-dimethylfluorene);9,9-diphenylfluorene;1-methylnaphthalene;2-methylnaphthalene;nonakis(2-methylpropane);toluene;tris(triphenylene)
SMILESCC(C)C.CC(C)C.CC(C)C.CC(C)C.CC(C)C.CC(C)C.CC(C)C.CC(C)C.CC(C)C.CC1(C)c2ccccc2-c2ccccc21.CC1(C)c2ccccc2-c2ccccc21.CCC1(CC)c2ccccc2-c2ccccc21.CCCCC1(CCC)c2ccccc2-c2ccccc21.Cc1ccc(C2(c3ccc(C)cc3)c3ccccc3-c3ccccc32)cc1.Cc1ccc2ccccc2c1.Cc1cccc2ccccc12.Cc1ccccc1.Cc1ccccc1.Cc1ccccc1.c1ccc(C2(c3ccccc3)c3ccccc3-c3ccccc32)cc1.c1ccc2c(c1)c1ccccc1c1ccccc21.c1ccc2c(c1)c1ccccc1c1ccccc21.c1ccc2c(c1)c1ccccc1c1ccccc21
InChIInChI=1S/C27H22.C25H18.C20H24.3C18H12.C17H18.2C15H14.2C11H10.3C7H8.9C4H10/c1-19-11-15-21(16-12-19)27(22-17-13-20(2)14-18-22)25-9-5-3-7-23(25)24-8-4-6-10-26(24)27;1-3-11-19(12-4-1)25(20-13-5-2-6-14-20)23-17-9-7-15-21(23)22-16-8-10-18-24(22)25;1-3-5-15-20(14-4-2)18-12-8-6-10-16(18)17-11-7-9-13-19(17)20;3*1-2-8-14-13(7-1)15-9-3-4-11-17(15)18-12-6-5-10-16(14)18;1-3-17(4-2)15-11-7-5-9-13(15)14-10-6-8-12-16(14)17;2*1-15(2)13-9-5-3-7-11(13)12-8-4-6-10-14(12)15;1-9-5-4-7-10-6-2-3-8-11(9)10;1-9-6-7-10-4-2-3-5-11(10)8-9;3*1-7-5-3-2-4-6-7;9*1-4(2)3/h3-18H,1-2H3;1-18H;6-13H,3-5,14-15H2,1-2H3;3*1-12H;5-12H,3-4H2,1-2H3;2*3-10H,1-2H3;2*2-8H,1H3;3*2-6H,1H3;9*4H,1-3H3
InChIKeyBXHVIBMPZHCAJR-UHFFFAOYSA-N
XLogP74.10
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds11
Heavy Atoms252
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5003309.01
LogP ≤ 574.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

Analyze 9,9-bis(4-methylphenyl)fluorene;9-butyl-9-propylfluorene;9,9-diethylfluorene;bis(9,9-dimethylfluorene);9,9-diphenylfluorene;1-methylnaphthalene;2-methylnaphthalene;nonakis(2-methylpropane);toluene;tris(triphenylene) with MolForge

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Related Compounds

9,9-dimethylfluorene;1-methylnaphthalene;2-methylnaphthalene;9-methyl-9-phenylfluorene;2-methyl-9,9'-spirobi[fluorene];toluene
CID 161053096
2-methyl-9,9-diphenylfluorene;1-methylnaphthalene;2-methylnaphthalene;1-methyl-2-phenylbenzene;2-methyl-9,9'-spirobi[fluorene];2,9,9-trimethylfluorene
CID 158540560
butane;2,2-dimethylpropane;ethane;1-methylnaphthalene;2-methylnaphthalene;9-methyl-9-phenylfluorene;2-methyl-9,9'-spirobi[fluorene];propane;toluene;2,9,9-trimethylfluorene
CID 160827106
9,9-bis(4-methylphenyl)fluorene;1,7-dimethylnaphthalene;2,3-dimethylnaphthalene;2,7-dimethylnaphthalene
CID 160966642
9,9-dimethyl-2-(4-methylphenyl)fluorene;2-methyl-9,9-diphenylfluorene;1-[4-(4-methylphenyl)phenyl]naphthalene;2-[4-(4-methylphenyl)phenyl]naphthalene
CID 157431212
9,9-dimethyl-2-[4-(4-propan-2-ylnaphthalen-1-yl)phenyl]fluorene;9,9-dioctyl-2-phenyl-7-propan-2-ylfluorene;9,9-dioctyl-2-propan-2-ylfluorene;9-naphthalen-1-yl-9-phenyl-2-propan-2-ylfluorene;9-naphthalen-2-yl-9-phenyl-2-propan-2-ylfluorene
CID 162067931
tetrakis(9,9-dimethylfluorene);tetrakis(9,9-diphenylfluorene);ethane;toluene
CID 157389689
CID 142294433
CID 142294433
2-methyl-9,9-diphenylfluorene;1-(2-methylphenyl)naphthalene;1-(3-methylphenyl)naphthalene;2-(2-methylphenyl)naphthalene;2-(3-methylphenyl)naphthalene;2-(4-methylphenyl)naphthalene
CID 158548033
3-methylfluoranthene;1-methylnaphthalene;1-methyl-4-phenylbenzene;1-methylpyrene;naphthalene;toluene;2,9,9-trimethylfluorene
CID 167628771
9-methylanthracene;2-methyl-9,9-dioctylfluorene;1-methylnaphthalene;1-methyl-5-naphthalen-1-ylnaphthalene;2-methyl-6-phenylanthracene;9-(4-methylphenyl)anthracene;9-methyl-10-phenylanthracene;1-methyl-4-phenylbenzene;1-(4-methylphenyl)naphthalene;1-methyl-4-phenylnaphthalene;1-methyl-5-phenylnaphthalene;2-methyl-6-phenylnaphthalene;toluene
CID 158882510
2-[3-[3-(9,9-diethylfluoren-2-yl)phenyl]phenyl]-4,6-diphenyl-1,3,5-triazine;2-[3-[3-(7,7-dimethylbenzo[c]fluoren-5-yl)phenyl]phenyl]-4,6-diphenyl-1,3,5-triazine;2,4-diphenyl-6-[3-[3-(9,9'-spirobi[fluorene]-1'-yl)phenyl]phenyl]-1,3,5-triazine;2-[3-[3-[9-(4-methylphenyl)-9-phenylfluoren-1-yl]phenyl]phenyl]-4,6-diphenyl-1,3,5-triazine
CID 162051775

Frequently Asked Questions

What is the IUPAC name of 9,9-bis(4-methylphenyl)fluorene;9-butyl-9-propylfluorene;9,9-diethylfluorene;bis(9,9-dimethylfluorene);9,9-diphenylfluorene;1-methylnaphthalene;2-methylnaphthalene;nonakis(2-methylpropane);toluene;tris(triphenylene)?
The IUPAC name of 9,9-bis(4-methylphenyl)fluorene;9-butyl-9-propylfluorene;9,9-diethylfluorene;bis(9,9-dimethylfluorene);9,9-diphenylfluorene;1-methylnaphthalene;2-methylnaphthalene;nonakis(2-methylpropane);toluene;tris(triphenylene) (CID 157491370) is 9,9-bis(4-methylphenyl)fluorene;9-butyl-9-propylfluorene;9,9-diethylfluorene;bis(9,9-dimethylfluorene);9,9-diphenylfluorene;1-methylnaphthalene;2-methylnaphthalene;nonakis(2-methylpropane);toluene;tris(triphenylene).
What is the SMILES notation for 9,9-bis(4-methylphenyl)fluorene;9-butyl-9-propylfluorene;9,9-diethylfluorene;bis(9,9-dimethylfluorene);9,9-diphenylfluorene;1-methylnaphthalene;2-methylnaphthalene;nonakis(2-methylpropane);toluene;tris(triphenylene)?
The canonical SMILES for 9,9-bis(4-methylphenyl)fluorene;9-butyl-9-propylfluorene;9,9-diethylfluorene;bis(9,9-dimethylfluorene);9,9-diphenylfluorene;1-methylnaphthalene;2-methylnaphthalene;nonakis(2-methylpropane);toluene;tris(triphenylene) is CC(C)C.CC(C)C.CC(C)C.CC(C)C.CC(C)C.CC(C)C.CC(C)C.CC(C)C.CC(C)C.CC1(C)c2ccccc2-c2ccccc21.CC1(C)c2ccccc2-c2ccccc21.CCC1(CC)c2ccccc2-c2ccccc21.CCCCC1(CCC)c2ccccc2-c2ccccc21.Cc1ccc(C2(c3ccc(C)cc3)c3ccccc3-c3ccccc32)cc1.Cc1ccc2ccccc2c1.Cc1cccc2ccccc12.Cc1ccccc1.Cc1ccccc1.Cc1ccccc1.c1ccc(C2(c3ccccc3)c3ccccc3-c3ccccc32)cc1.c1ccc2c(c1)c1ccccc1c1ccccc21.c1ccc2c(c1)c1ccccc1c1ccccc21.c1ccc2c(c1)c1ccccc1c1ccccc21.
What is the InChIKey of 9,9-bis(4-methylphenyl)fluorene;9-butyl-9-propylfluorene;9,9-diethylfluorene;bis(9,9-dimethylfluorene);9,9-diphenylfluorene;1-methylnaphthalene;2-methylnaphthalene;nonakis(2-methylpropane);toluene;tris(triphenylene)?
The InChIKey is BXHVIBMPZHCAJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H22.C25H18.C20H24.3C18H12.C17H18.2C15H14.2C11H10.3C7H8.9C4H10/c1-19-11-15-21(16-12-19)27(22-17-13-20(2)14-18-22)25-9-5-3-7-23(25)24-8-4-6-10-26(24)27;1-3-11-19(12-4-1)25(20-13-5-2-6-14-20)23-17-9-7-15-21(23)22-16-8-10-18-24(22)25;1-3-5-15-20(14-4-2)18-12-8-6-10-16(18)17-11-7-9-13-19(17)20;3*1-2-8-14-13(7-1)15-9-3-4-11-17(15)18-12-6-5-10-16(14)18;1-3-17(4-2)15-11-7-5-9-13(15)14-10-6-8-12-16(14)17;2*1-15(2)13-9-5-3-7-11(13)12-8-4-6-10-14(12)15;1-9-5-4-7-10-6-2-3-8-11(9)10;1-9-6-7-10-4-2-3-5-11(10)8-9;3*1-7-5-3-2-4-6-7;9*1-4(2)3/h3-18H,1-2H3;1-18H;6-13H,3-5,14-15H2,1-2H3;3*1-12H;5-12H,3-4H2,1-2H3;2*3-10H,1-2H3;2*2-8H,1H3;3*2-6H,1H3;9*4H,1-3H3.
What are the key properties of 9,9-bis(4-methylphenyl)fluorene;9-butyl-9-propylfluorene;9,9-diethylfluorene;bis(9,9-dimethylfluorene);9,9-diphenylfluorene;1-methylnaphthalene;2-methylnaphthalene;nonakis(2-methylpropane);toluene;tris(triphenylene)?
9,9-bis(4-methylphenyl)fluorene;9-butyl-9-propylfluorene;9,9-diethylfluorene;bis(9,9-dimethylfluorene);9,9-diphenylfluorene;1-methylnaphthalene;2-methylnaphthalene;nonakis(2-methylpropane);toluene;tris(triphenylene) has a molecular weight of 3309.01 g/mol, XLogP of 74.10, 11 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 9,9-bis(4-methylphenyl)fluorene;9-butyl-9-propylfluorene;9,9-diethylfluorene;bis(9,9-dimethylfluorene);9,9-diphenylfluorene;1-methylnaphthalene;2-methylnaphthalene;nonakis(2-methylpropane);toluene;tris(triphenylene) is sourced from PubChem (CID 157491370), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).