dibenzofuran;dibenzothiophene;9,9-dimethylfluorene;2,2-dimethylpentane;9,9-dimethyl-1-phenylfluorene;decakis(2,2-dimethylpropane);bis(9-phenylcarbazole);4-phenyldibenzofuran;4-phenyldibenzothiophene;bis(1-phenylnaphthalene);2-phenylnaphthalene

C237H270N2O2S2 — CID 159548158

IUPACdibenzofuran;dibenzothiophene;9,9-dimethylfluorene;2,2-dimethylpentane;9,9-dimethyl-1-phenylfluorene;decakis(2,2-dimethylpropane);bis(9-phenylcarbazole);4-phenyldibenzofuran;4-phenyldibenzothiophene;bis(1-phenylnaphthalene);2-phenylnaphthalene
SMILESCC(C)(C)C.CC(C)(C)C.CC(C)(C)C.CC(C)(C)C.CC(C)(C)C.CC(C)(C)C.CC(C)(C)C.CC(C)(C)C.CC(C)(C)C.CC(C)(C)C.CC1(C)c2ccccc2-c2cccc(-c3ccccc3)c21.CC1(C)c2ccccc2-c2ccccc21.CCCC(C)(C)C.c1ccc(-c2ccc3ccccc3c2)cc1.c1ccc(-c2cccc3c2oc2ccccc23)cc1.c1ccc(-c2cccc3c2sc2ccccc23)cc1.c1ccc(-c2cccc3ccccc23)cc1.c1ccc(-c2cccc3ccccc23)cc1.c1ccc(-n2c3ccccc3c3ccccc32)cc1.c1ccc(-n2c3ccccc3c3ccccc32)cc1.c1ccc2c(c1)oc1ccccc12.c1ccc2c(c1)sc1ccccc12
InChIInChI=1S/C21H18.2C18H13N.C18H12O.C18H12S.3C16H12.C15H14.C12H8O.C12H8S.C7H16.10C5H12/c1-21(2)19-14-7-6-11-17(19)18-13-8-12-16(20(18)21)15-9-4-3-5-10-15;2*1-2-8-14(9-3-1)19-17-12-6-4-10-15(17)16-11-5-7-13-18(16)19;2*1-2-7-13(8-3-1)14-10-6-11-16-15-9-4-5-12-17(15)19-18(14)16;2*1-2-7-13(8-3-1)16-12-6-10-14-9-4-5-11-15(14)16;1-2-6-13(7-3-1)16-11-10-14-8-4-5-9-15(14)12-16;1-15(2)13-9-5-3-7-11(13)12-8-4-6-10-14(12)15;2*1-3-7-11-9(5-1)10-6-2-4-8-12(10)13-11;1-5-6-7(2,3)4;10*1-5(2,3)4/h3-14H,1-2H3;2*1-13H;2*1-12H;3*1-12H;3-10H,1-2H3;2*1-8H;5-6H2,1-4H3;10*1-4H3
InChIKeyMFBCWGHLKIXBEN-UHFFFAOYSA-N
MW3242.91 g/mol
LogP74.71
Rot. Bonds9

About dibenzofuran;dibenzothiophene;9,9-dimethylfluorene;2,2-dimethylpentane;9,9-dimethyl-1-phenylfluorene;decakis(2,2-dimethylpropane);bis(9-phenylcarbazole);4-phenyldibenzofuran;4-phenyldibenzothiophene;bis(1-phenylnaphthalene);2-phenylnaphthalene

dibenzofuran;dibenzothiophene;9,9-dimethylfluorene;2,2-dimethylpentane;9,9-dimethyl-1-phenylfluorene;decakis(2,2-dimethylpropane);bis(9-phenylcarbazole);4-phenyldibenzofuran;4-phenyldibenzothiophene;bis(1-phenylnaphthalene);2-phenylnaphthalene (PubChem CID 159548158) has the molecular formula C237H270N2O2S2 and a molecular weight of 3242.91 g/mol. Its IUPAC name is dibenzofuran;dibenzothiophene;9,9-dimethylfluorene;2,2-dimethylpentane;9,9-dimethyl-1-phenylfluorene;decakis(2,2-dimethylpropane);bis(9-phenylcarbazole);4-phenyldibenzofuran;4-phenyldibenzothiophene;bis(1-phenylnaphthalene);2-phenylnaphthalene.

Molecular Properties

Compound Namedibenzofuran;dibenzothiophene;9,9-dimethylfluorene;2,2-dimethylpentane;9,9-dimethyl-1-phenylfluorene;decakis(2,2-dimethylpropane);bis(9-phenylcarbazole);4-phenyldibenzofuran;4-phenyldibenzothiophene;bis(1-phenylnaphthalene);2-phenylnaphthalene
PubChem CID159548158
Molecular FormulaC237H270N2O2S2
Molecular Weight3242.91 g/mol
Exact Mass3240.05
IUPAC Namedibenzofuran;dibenzothiophene;9,9-dimethylfluorene;2,2-dimethylpentane;9,9-dimethyl-1-phenylfluorene;decakis(2,2-dimethylpropane);bis(9-phenylcarbazole);4-phenyldibenzofuran;4-phenyldibenzothiophene;bis(1-phenylnaphthalene);2-phenylnaphthalene
SMILESCC(C)(C)C.CC(C)(C)C.CC(C)(C)C.CC(C)(C)C.CC(C)(C)C.CC(C)(C)C.CC(C)(C)C.CC(C)(C)C.CC(C)(C)C.CC(C)(C)C.CC1(C)c2ccccc2-c2cccc(-c3ccccc3)c21.CC1(C)c2ccccc2-c2ccccc21.CCCC(C)(C)C.c1ccc(-c2ccc3ccccc3c2)cc1.c1ccc(-c2cccc3c2oc2ccccc23)cc1.c1ccc(-c2cccc3c2sc2ccccc23)cc1.c1ccc(-c2cccc3ccccc23)cc1.c1ccc(-c2cccc3ccccc23)cc1.c1ccc(-n2c3ccccc3c3ccccc32)cc1.c1ccc(-n2c3ccccc3c3ccccc32)cc1.c1ccc2c(c1)oc1ccccc12.c1ccc2c(c1)sc1ccccc12
InChIInChI=1S/C21H18.2C18H13N.C18H12O.C18H12S.3C16H12.C15H14.C12H8O.C12H8S.C7H16.10C5H12/c1-21(2)19-14-7-6-11-17(19)18-13-8-12-16(20(18)21)15-9-4-3-5-10-15;2*1-2-8-14(9-3-1)19-17-12-6-4-10-15(17)16-11-5-7-13-18(16)19;2*1-2-7-13(8-3-1)14-10-6-11-16-15-9-4-5-12-17(15)19-18(14)16;2*1-2-7-13(8-3-1)16-12-6-10-14-9-4-5-11-15(14)16;1-2-6-13(7-3-1)16-11-10-14-8-4-5-9-15(14)12-16;1-15(2)13-9-5-3-7-11(13)12-8-4-6-10-14(12)15;2*1-3-7-11-9(5-1)10-6-2-4-8-12(10)13-11;1-5-6-7(2,3)4;10*1-5(2,3)4/h3-14H,1-2H3;2*1-13H;2*1-12H;3*1-12H;3-10H,1-2H3;2*1-8H;5-6H2,1-4H3;10*1-4H3
InChIKeyMFBCWGHLKIXBEN-UHFFFAOYSA-N
XLogP74.71
TPSA36.14 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds9
Heavy Atoms243
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5003242.91
LogP ≤ 574.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze dibenzofuran;dibenzothiophene;9,9-dimethylfluorene;2,2-dimethylpentane;9,9-dimethyl-1-phenylfluorene;decakis(2,2-dimethylpropane);bis(9-phenylcarbazole);4-phenyldibenzofuran;4-phenyldibenzothiophene;bis(1-phenylnaphthalene);2-phenylnaphthalene with MolForge

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Related Compounds

N-(4-dibenzofuran-2-ylphenyl)-N-(4-dibenzofuran-4-ylphenyl)-4-(9-phenylcarbazol-3-yl)aniline;N-(4-dibenzofuran-4-ylphenyl)-N-(4-dibenzothiophen-4-ylphenyl)-4-(9-phenylcarbazol-3-yl)aniline;N-(4-dibenzofuran-2-ylphenyl)-4-phenyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]aniline;N-(4-dibenzothiophen-2-ylphenyl)-9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]fluoren-2-amine;N-(4-dibenzothiophen-2-ylphenyl)-N-[4-(9-phenylcarbazol-3-yl)phenyl]naphthalen-1-amine;N-(4-dibenzothiophen-2-ylphenyl)-4-phenyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]aniline
CID 158039277
5-[3-(4-dibenzofuran-4-ylphenyl)phenyl]-7,7-dimethylindeno[2,1-b]carbazole;5-(3-dibenzothiophen-4-ylphenyl)-7,7-dimethyl-3-phenylindeno[2,1-b]carbazole;5-(4-dibenzothiophen-4-ylphenyl)-7,7-dimethyl-3-phenylindeno[2,1-b]carbazole
CID 159212687
9-[3-(9,9-dimethylfluoren-1-yl)phenyl]-10-naphthalen-2-ylanthracene;4-[3-(10-naphthalen-2-ylanthracen-9-yl)phenyl]dibenzofuran;4-[3-(10-naphthalen-2-ylanthracen-9-yl)phenyl]dibenzothiophene;2-[3-[10-(4-phenylnaphthalen-1-yl)anthracen-9-yl]phenyl]dibenzofuran;2-[3-[10-(4-phenylnaphthalen-1-yl)anthracen-9-yl]phenyl]dibenzothiophene
CID 161193830
2-dibenzofuran-4-yl-6-[4-(9-naphthalen-2-ylcarbazol-3-yl)phenyl]-9-phenylcarbazole;3-dibenzofuran-4-yl-9-phenyl-6-[3-(9-phenylcarbazol-3-yl)phenyl]carbazole;2-dibenzothiophen-4-yl-6-[4-(9-naphthalen-2-ylcarbazol-3-yl)phenyl]-9-phenylcarbazole;3-dibenzothiophen-4-yl-9-phenyl-6-[3-(9-phenylcarbazol-3-yl)phenyl]carbazole
CID 159942407
2-dibenzofuran-4-yl-6-[4-(9-naphthalen-2-ylcarbazol-3-yl)phenyl]-9-phenylcarbazole;2-dibenzofuran-4-yl-9-phenyl-6-[3-(9-phenylcarbazol-3-yl)phenyl]carbazole;3-dibenzofuran-4-yl-9-phenyl-6-[3-(9-phenylcarbazol-3-yl)phenyl]carbazole;2-dibenzothiophen-4-yl-6-[4-(9-naphthalen-2-ylcarbazol-3-yl)phenyl]-9-phenylcarbazole;3-dibenzothiophen-4-yl-6-[4-(9-naphthalen-2-ylcarbazol-3-yl)phenyl]-9-phenylcarbazole;3-dibenzothiophen-4-yl-9-phenyl-6-[3-(9-phenylcarbazol-3-yl)phenyl]carbazole
CID 157382903
11-(4-dibenzofuran-1-ylphenyl)-5-phenylindolo[3,2-b]carbazole;11-(4-dibenzofuran-2-ylphenyl)-5-phenylindolo[3,2-b]carbazole;11-(4-dibenzofuran-4-ylphenyl)-5-phenylindolo[3,2-b]carbazole;11-(4-dibenzothiophen-1-ylphenyl)-5-phenylindolo[3,2-b]carbazole;11-(4-dibenzothiophen-4-ylphenyl)-5-phenylindolo[3,2-b]carbazole;11-[4-(9,9-dimethylfluoren-3-yl)phenyl]-5-phenylindolo[3,2-b]carbazole
CID 161290833
3-[3-[10-(3-dibenzofuran-4-ylphenyl)anthracen-9-yl]phenyl]-9-phenylcarbazole;3-[3-[10-(4-dibenzofuran-4-ylphenyl)anthracen-9-yl]phenyl]-9-phenylcarbazole;2-[3-[10-(3-naphthalen-1-ylphenyl)anthracen-9-yl]phenyl]dibenzothiophene;2-[3-[10-(3-naphthalen-2-ylphenyl)anthracen-9-yl]phenyl]dibenzothiophene;2-[4-[10-(3-naphthalen-2-ylphenyl)anthracen-9-yl]phenyl]dibenzothiophene
CID 161110671
6-(4-carbazol-9-ylphenyl)-2-dibenzofuran-4-yl-9-naphthalen-2-ylcarbazole;6-(4-carbazol-9-ylphenyl)-2-dibenzofuran-4-yl-9-(4-naphthalen-2-ylphenyl)carbazole;6-(4-carbazol-9-ylphenyl)-2-dibenzothiophen-4-yl-9-naphthalen-2-ylcarbazole;6-(4-carbazol-9-ylphenyl)-2-dibenzothiophen-4-yl-9-(4-naphthalen-2-ylphenyl)carbazole
CID 161381988
6-(4-carbazol-9-ylphenyl)-2-dibenzofuran-4-yl-9-naphthalen-2-ylcarbazole;6-(4-carbazol-9-ylphenyl)-2-dibenzofuran-4-yl-9-(4-naphthalen-2-ylphenyl)carbazole;6-(4-carbazol-9-ylphenyl)-2-dibenzothiophen-4-yl-9-(4-naphthalen-2-ylphenyl)carbazole
CID 162161949
5-(2-dibenzofuran-4-ylquinazolin-4-yl)-2-(9,9-dimethylfluoren-2-yl)benzo[b]carbazole;5-(2-dibenzothiophen-4-ylquinazolin-4-yl)-2-phenylbenzo[b]carbazole;5-[2-(9,9-dimethylfluoren-1-yl)quinazolin-4-yl]-2-naphthalen-2-ylbenzo[b]carbazole
CID 159895032
N-(3-dibenzofuran-4-ylphenyl)-9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]fluoren-2-amine;N-(3-dibenzothiophen-4-ylphenyl)-9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]fluoren-2-amine;9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]-N-(3-triphenylen-2-ylphenyl)fluoren-2-amine
CID 158948861
2-[10-(9,9-dimethylfluoren-2-yl)anthracen-9-yl]dibenzofuran;1-[10-(3,5-diphenylphenyl)anthracen-9-yl]dibenzothiophene;4-methyl-6-[3-(10-naphthalen-2-ylanthracen-9-yl)phenyl]dibenzofuran;4-[3-[10-(3-naphthalen-2-ylphenyl)anthracen-9-yl]phenyl]dibenzothiophene;9-[4-(10-phenylanthracen-9-yl)phenyl]carbazole
CID 161368408

Frequently Asked Questions

What is the IUPAC name of dibenzofuran;dibenzothiophene;9,9-dimethylfluorene;2,2-dimethylpentane;9,9-dimethyl-1-phenylfluorene;decakis(2,2-dimethylpropane);bis(9-phenylcarbazole);4-phenyldibenzofuran;4-phenyldibenzothiophene;bis(1-phenylnaphthalene);2-phenylnaphthalene?
The IUPAC name of dibenzofuran;dibenzothiophene;9,9-dimethylfluorene;2,2-dimethylpentane;9,9-dimethyl-1-phenylfluorene;decakis(2,2-dimethylpropane);bis(9-phenylcarbazole);4-phenyldibenzofuran;4-phenyldibenzothiophene;bis(1-phenylnaphthalene);2-phenylnaphthalene (CID 159548158) is dibenzofuran;dibenzothiophene;9,9-dimethylfluorene;2,2-dimethylpentane;9,9-dimethyl-1-phenylfluorene;decakis(2,2-dimethylpropane);bis(9-phenylcarbazole);4-phenyldibenzofuran;4-phenyldibenzothiophene;bis(1-phenylnaphthalene);2-phenylnaphthalene.
What is the SMILES notation for dibenzofuran;dibenzothiophene;9,9-dimethylfluorene;2,2-dimethylpentane;9,9-dimethyl-1-phenylfluorene;decakis(2,2-dimethylpropane);bis(9-phenylcarbazole);4-phenyldibenzofuran;4-phenyldibenzothiophene;bis(1-phenylnaphthalene);2-phenylnaphthalene?
The canonical SMILES for dibenzofuran;dibenzothiophene;9,9-dimethylfluorene;2,2-dimethylpentane;9,9-dimethyl-1-phenylfluorene;decakis(2,2-dimethylpropane);bis(9-phenylcarbazole);4-phenyldibenzofuran;4-phenyldibenzothiophene;bis(1-phenylnaphthalene);2-phenylnaphthalene is CC(C)(C)C.CC(C)(C)C.CC(C)(C)C.CC(C)(C)C.CC(C)(C)C.CC(C)(C)C.CC(C)(C)C.CC(C)(C)C.CC(C)(C)C.CC(C)(C)C.CC1(C)c2ccccc2-c2cccc(-c3ccccc3)c21.CC1(C)c2ccccc2-c2ccccc21.CCCC(C)(C)C.c1ccc(-c2ccc3ccccc3c2)cc1.c1ccc(-c2cccc3c2oc2ccccc23)cc1.c1ccc(-c2cccc3c2sc2ccccc23)cc1.c1ccc(-c2cccc3ccccc23)cc1.c1ccc(-c2cccc3ccccc23)cc1.c1ccc(-n2c3ccccc3c3ccccc32)cc1.c1ccc(-n2c3ccccc3c3ccccc32)cc1.c1ccc2c(c1)oc1ccccc12.c1ccc2c(c1)sc1ccccc12.
What is the InChIKey of dibenzofuran;dibenzothiophene;9,9-dimethylfluorene;2,2-dimethylpentane;9,9-dimethyl-1-phenylfluorene;decakis(2,2-dimethylpropane);bis(9-phenylcarbazole);4-phenyldibenzofuran;4-phenyldibenzothiophene;bis(1-phenylnaphthalene);2-phenylnaphthalene?
The InChIKey is MFBCWGHLKIXBEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H18.2C18H13N.C18H12O.C18H12S.3C16H12.C15H14.C12H8O.C12H8S.C7H16.10C5H12/c1-21(2)19-14-7-6-11-17(19)18-13-8-12-16(20(18)21)15-9-4-3-5-10-15;2*1-2-8-14(9-3-1)19-17-12-6-4-10-15(17)16-11-5-7-13-18(16)19;2*1-2-7-13(8-3-1)14-10-6-11-16-15-9-4-5-12-17(15)19-18(14)16;2*1-2-7-13(8-3-1)16-12-6-10-14-9-4-5-11-15(14)16;1-2-6-13(7-3-1)16-11-10-14-8-4-5-9-15(14)12-16;1-15(2)13-9-5-3-7-11(13)12-8-4-6-10-14(12)15;2*1-3-7-11-9(5-1)10-6-2-4-8-12(10)13-11;1-5-6-7(2,3)4;10*1-5(2,3)4/h3-14H,1-2H3;2*1-13H;2*1-12H;3*1-12H;3-10H,1-2H3;2*1-8H;5-6H2,1-4H3;10*1-4H3.
What are the key properties of dibenzofuran;dibenzothiophene;9,9-dimethylfluorene;2,2-dimethylpentane;9,9-dimethyl-1-phenylfluorene;decakis(2,2-dimethylpropane);bis(9-phenylcarbazole);4-phenyldibenzofuran;4-phenyldibenzothiophene;bis(1-phenylnaphthalene);2-phenylnaphthalene?
dibenzofuran;dibenzothiophene;9,9-dimethylfluorene;2,2-dimethylpentane;9,9-dimethyl-1-phenylfluorene;decakis(2,2-dimethylpropane);bis(9-phenylcarbazole);4-phenyldibenzofuran;4-phenyldibenzothiophene;bis(1-phenylnaphthalene);2-phenylnaphthalene has a molecular weight of 3242.91 g/mol, XLogP of 74.71, 9 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for dibenzofuran;dibenzothiophene;9,9-dimethylfluorene;2,2-dimethylpentane;9,9-dimethyl-1-phenylfluorene;decakis(2,2-dimethylpropane);bis(9-phenylcarbazole);4-phenyldibenzofuran;4-phenyldibenzothiophene;bis(1-phenylnaphthalene);2-phenylnaphthalene is sourced from PubChem (CID 159548158), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).