9,10-dimethylanthracene;9,9-dimethylfluorene;2,5-dimethylfuran;1,5-dimethylnaphthalene;2,5-dimethylselenophene;ethane;9-methylcarbazole;pentacene;pyridine;tetracene;2,7,12,17-tetramethyl-6,16-dithiapentacyclo[11.7.0.03,11.05,9.015,19]icosa-1,3(11),4,7,9,12,14,17,19-nonaene;1,2,4,5-tetramethylpyrrolo[3,4-c]pyrrole-3,6-dione;2,3,5,6-tetramethylthieno[3,2-b]thiophene;2,4,6,8-tetramethylthieno[2,3-f][1]benzothiole;1,2,5-trimethylpyrrole;2,4,5-trimethyl-1,3-thiazole

C210H258N6O3S7Se — CID 158755735

IUPAC9,10-dimethylanthracene;9,9-dimethylfluorene;2,5-dimethylfuran;1,5-dimethylnaphthalene;2,5-dimethylselenophene;ethane;9-methylcarbazole;pentacene;pyridine;tetracene;2,7,12,17-tetramethyl-6,16-dithiapentacyclo[11.7.0.03,11.05,9.015,19]icosa-1,3(11),4,7,9,12,14,17,19-nonaene;1,2,4,5-tetramethylpyrrolo[3,4-c]pyrrole-3,6-dione;2,3,5,6-tetramethylthieno[3,2-b]thiophene;2,4,6,8-tetramethylthieno[2,3-f][1]benzothiole;1,2,5-trimethylpyrrole;2,4,5-trimethyl-1,3-thiazole
SMILESCC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC1(C)c2ccccc2-c2ccccc21.CC1=C2C(=O)N(C)C(C)=C2C(=O)N1C.Cc1c2ccccc2c(C)c2ccccc12.Cc1cc2c(C)c3sc(C)cc3c(C)c2s1.Cc1cc2cc3c(C)c4cc5sc(C)cc5cc4c(C)c3cc2s1.Cc1ccc(C)[se]1.Cc1ccc(C)n1C.Cc1ccc(C)o1.Cc1cccc2c(C)cccc12.Cc1nc(C)c(C)s1.Cc1sc2c(C)c(C)sc2c1C.Cn1c2ccccc2c2ccccc21.c1ccc2cc3cc4cc5ccccc5cc4cc3cc2c1.c1ccc2cc3cc4ccccc4cc3cc2c1.c1ccncc1
InChIInChI=1S/C22H18S2.C22H14.C18H12.C16H14.C15H14.C14H14S2.C13H11N.C12H12.C10H12N2O2.C10H12S2.C7H11N.C6H9NS.C6H8O.C6H8Se.C5H5N.14C2H6/c1-11-5-15-7-17-13(3)20-10-22-16(6-12(2)24-22)8-18(20)14(4)19(17)9-21(15)23-11;1-2-6-16-10-20-14-22-12-18-8-4-3-7-17(18)11-21(22)13-19(20)9-15(16)5-1;1-2-6-14-10-18-12-16-8-4-3-7-15(16)11-17(18)9-13(14)5-1;1-11-13-7-3-5-9-15(13)12(2)16-10-6-4-8-14(11)16;1-15(2)13-9-5-3-7-11(13)12-8-4-6-10-14(12)15;1-7-5-11-9(3)14-12(6-8(2)16-14)10(4)13(11)15-7;1-14-12-8-4-2-6-10(12)11-7-3-5-9-13(11)14;1-9-5-3-8-12-10(2)6-4-7-11(9)12;1-5-7-8(10(14)11(5)3)6(2)12(4)9(7)13;1-5-7(3)11-10-6(2)8(4)12-9(5)10;1-6-4-5-7(2)8(6)3;1-4-5(2)8-6(3)7-4;2*1-5-3-4-6(2)7-5;1-2-4-6-5-3-1;14*1-2/h5-10H,1-4H3;1-14H;1-12H;3-10H,1-2H3;3-10H,1-2H3;5-6H,1-4H3;2-9H,1H3;3-8H,1-2H3;1-4H3;1-4H3;4-5H,1-3H3;1-3H3;2*3-4H,1-2H3;1-5H;14*1-2H3
InChIKeyIOAZTSBLSVMTPL-UHFFFAOYSA-N
MW3217.84 g/mol
LogP66.93
Rot. Bonds

About 9,10-dimethylanthracene;9,9-dimethylfluorene;2,5-dimethylfuran;1,5-dimethylnaphthalene;2,5-dimethylselenophene;ethane;9-methylcarbazole;pentacene;pyridine;tetracene;2,7,12,17-tetramethyl-6,16-dithiapentacyclo[11.7.0.03,11.05,9.015,19]icosa-1,3(11),4,7,9,12,14,17,19-nonaene;1,2,4,5-tetramethylpyrrolo[3,4-c]pyrrole-3,6-dione;2,3,5,6-tetramethylthieno[3,2-b]thiophene;2,4,6,8-tetramethylthieno[2,3-f][1]benzothiole;1,2,5-trimethylpyrrole;2,4,5-trimethyl-1,3-thiazole

9,10-dimethylanthracene;9,9-dimethylfluorene;2,5-dimethylfuran;1,5-dimethylnaphthalene;2,5-dimethylselenophene;ethane;9-methylcarbazole;pentacene;pyridine;tetracene;2,7,12,17-tetramethyl-6,16-dithiapentacyclo[11.7.0.03,11.05,9.015,19]icosa-1,3(11),4,7,9,12,14,17,19-nonaene;1,2,4,5-tetramethylpyrrolo[3,4-c]pyrrole-3,6-dione;2,3,5,6-tetramethylthieno[3,2-b]thiophene;2,4,6,8-tetramethylthieno[2,3-f][1]benzothiole;1,2,5-trimethylpyrrole;2,4,5-trimethyl-1,3-thiazole (PubChem CID 158755735) has the molecular formula C210H258N6O3S7Se and a molecular weight of 3217.84 g/mol. Its IUPAC name is 9,10-dimethylanthracene;9,9-dimethylfluorene;2,5-dimethylfuran;1,5-dimethylnaphthalene;2,5-dimethylselenophene;ethane;9-methylcarbazole;pentacene;pyridine;tetracene;2,7,12,17-tetramethyl-6,16-dithiapentacyclo[11.7.0.03,11.05,9.015,19]icosa-1,3(11),4,7,9,12,14,17,19-nonaene;1,2,4,5-tetramethylpyrrolo[3,4-c]pyrrole-3,6-dione;2,3,5,6-tetramethylthieno[3,2-b]thiophene;2,4,6,8-tetramethylthieno[2,3-f][1]benzothiole;1,2,5-trimethylpyrrole;2,4,5-trimethyl-1,3-thiazole.

Molecular Properties

Compound Name9,10-dimethylanthracene;9,9-dimethylfluorene;2,5-dimethylfuran;1,5-dimethylnaphthalene;2,5-dimethylselenophene;ethane;9-methylcarbazole;pentacene;pyridine;tetracene;2,7,12,17-tetramethyl-6,16-dithiapentacyclo[11.7.0.03,11.05,9.015,19]icosa-1,3(11),4,7,9,12,14,17,19-nonaene;1,2,4,5-tetramethylpyrrolo[3,4-c]pyrrole-3,6-dione;2,3,5,6-tetramethylthieno[3,2-b]thiophene;2,4,6,8-tetramethylthieno[2,3-f][1]benzothiole;1,2,5-trimethylpyrrole;2,4,5-trimethyl-1,3-thiazole
PubChem CID158755735
Molecular FormulaC210H258N6O3S7Se
Molecular Weight3217.84 g/mol
Exact Mass3215.74
IUPAC Name9,10-dimethylanthracene;9,9-dimethylfluorene;2,5-dimethylfuran;1,5-dimethylnaphthalene;2,5-dimethylselenophene;ethane;9-methylcarbazole;pentacene;pyridine;tetracene;2,7,12,17-tetramethyl-6,16-dithiapentacyclo[11.7.0.03,11.05,9.015,19]icosa-1,3(11),4,7,9,12,14,17,19-nonaene;1,2,4,5-tetramethylpyrrolo[3,4-c]pyrrole-3,6-dione;2,3,5,6-tetramethylthieno[3,2-b]thiophene;2,4,6,8-tetramethylthieno[2,3-f][1]benzothiole;1,2,5-trimethylpyrrole;2,4,5-trimethyl-1,3-thiazole
SMILESCC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC1(C)c2ccccc2-c2ccccc21.CC1=C2C(=O)N(C)C(C)=C2C(=O)N1C.Cc1c2ccccc2c(C)c2ccccc12.Cc1cc2c(C)c3sc(C)cc3c(C)c2s1.Cc1cc2cc3c(C)c4cc5sc(C)cc5cc4c(C)c3cc2s1.Cc1ccc(C)[se]1.Cc1ccc(C)n1C.Cc1ccc(C)o1.Cc1cccc2c(C)cccc12.Cc1nc(C)c(C)s1.Cc1sc2c(C)c(C)sc2c1C.Cn1c2ccccc2c2ccccc21.c1ccc2cc3cc4cc5ccccc5cc4cc3cc2c1.c1ccc2cc3cc4ccccc4cc3cc2c1.c1ccncc1
InChIInChI=1S/C22H18S2.C22H14.C18H12.C16H14.C15H14.C14H14S2.C13H11N.C12H12.C10H12N2O2.C10H12S2.C7H11N.C6H9NS.C6H8O.C6H8Se.C5H5N.14C2H6/c1-11-5-15-7-17-13(3)20-10-22-16(6-12(2)24-22)8-18(20)14(4)19(17)9-21(15)23-11;1-2-6-16-10-20-14-22-12-18-8-4-3-7-17(18)11-21(22)13-19(20)9-15(16)5-1;1-2-6-14-10-18-12-16-8-4-3-7-15(16)11-17(18)9-13(14)5-1;1-11-13-7-3-5-9-15(13)12(2)16-10-6-4-8-14(11)16;1-15(2)13-9-5-3-7-11(13)12-8-4-6-10-14(12)15;1-7-5-11-9(3)14-12(6-8(2)16-14)10(4)13(11)15-7;1-14-12-8-4-2-6-10(12)11-7-3-5-9-13(11)14;1-9-5-3-8-12-10(2)6-4-7-11(9)12;1-5-7-8(10(14)11(5)3)6(2)12(4)9(7)13;1-5-7(3)11-10-6(2)8(4)12-9(5)10;1-6-4-5-7(2)8(6)3;1-4-5(2)8-6(3)7-4;2*1-5-3-4-6(2)7-5;1-2-4-6-5-3-1;14*1-2/h5-10H,1-4H3;1-14H;1-12H;3-10H,1-2H3;3-10H,1-2H3;5-6H,1-4H3;2-9H,1H3;3-8H,1-2H3;1-4H3;1-4H3;4-5H,1-3H3;1-3H3;2*3-4H,1-2H3;1-5H;14*1-2H3
InChIKeyIOAZTSBLSVMTPL-UHFFFAOYSA-N
XLogP66.93
TPSA89.40 Ų
H-Bond Donors
H-Bond Acceptors14
Rotatable Bonds
Heavy Atoms227
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003217.84
LogP ≤ 566.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1014

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'ene_five_het_C(85)', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}

Analyze 9,10-dimethylanthracene;9,9-dimethylfluorene;2,5-dimethylfuran;1,5-dimethylnaphthalene;2,5-dimethylselenophene;ethane;9-methylcarbazole;pentacene;pyridine;tetracene;2,7,12,17-tetramethyl-6,16-dithiapentacyclo[11.7.0.03,11.05,9.015,19]icosa-1,3(11),4,7,9,12,14,17,19-nonaene;1,2,4,5-tetramethylpyrrolo[3,4-c]pyrrole-3,6-dione;2,3,5,6-tetramethylthieno[3,2-b]thiophene;2,4,6,8-tetramethylthieno[2,3-f][1]benzothiole;1,2,5-trimethylpyrrole;2,4,5-trimethyl-1,3-thiazole with MolForge

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Related Compounds

9-(1-Benzofuran-2-yl)-5-(9,9-dimethylfluoren-3-yl)-27-(4-methylphenyl)-23-pyridin-3-yl-31-thia-9,27-diazaoctacyclo[15.14.0.02,10.03,8.011,16.018,30.020,28.021,26]hentriaconta-1(17),2(10),3(8),4,6,11,13,15,18(30),19,21(26),22,24,28-tetradecaene
CID 130398100
but-2-ene;but-2-yne;9,10-dimethylanthracene;2,7-dimethyl-9H-fluorene;2,5-dimethylfuran;1,4-dimethylnaphthalene;2,5-dimethylpyridine;5,12-dimethyltetracene;2,5-dimethyl-1,3-thiazole;2,5-dimethylthieno[3,2-b]thiophene;2,6-dimethylthieno[2,3-f][1]benzothiole;2,5-dimethylthiophene;3,6,9-trimethylcarbazole;1,2,5-trimethylpyrrole;1,4-xylene
CID 157258742
Benzene;9,10-dimethylanthracene;9,9-dimethylfluorene;2,5-dimethylfuran;1,5-dimethylnaphthalene;6,13-dimethylpentacene;2,5-dimethylselenophene;ethane;9-methylcarbazole;pyridine;tetracene;2,7,12,17-tetramethyl-6,16-dithiapentacyclo[11.7.0.03,11.05,9.015,19]icosa-1,3(11),4,7,9,12,14,17,19-nonaene;1,2,4,5-tetramethylpyrrolo[3,4-c]pyrrole-3,6-dione;2,3,5,6-tetramethylthieno[3,2-b]thiophene;2,4,6,8-tetramethylthieno[2,3-f][1]benzothiole;1,2,5-trimethylpyrrole;2,4,5-trimethyl-1,3-thiazole;2,3,5-trimethylthiophene
CID 157553901
benzene;but-2-ene;but-2-yne;7,17-dimethyl-6,16-dithiapentacyclo[11.7.0.03,11.05,9.015,19]icosa-1,3(11),4,7,9,12,14,17,19-nonaene;9,9-dimethylfluorene;2,5-dimethyl-[1,3]thiazolo[5,4-d][1,3]thiazole;ethane;N-methylethanimine;9-methyl-9H-fluorene;pentacene;4,5,7,9,10-pentamethyl-3,11-dithia-7-azatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraene;1,2,3,4,5-pentamethylpyrrole;pyridine;tetracene;2,3,4,5-tetramethylfuran;2,3,4,5-tetramethylselenophene;2,4,6,8-tetramethylthieno[2,3-f][1]benzothiole;2,3,4,5-tetramethylthiophene;2,4,5-trimethyl-1,3-thiazole
CID 157742359
2-Cyclohexyl-6-(4-naphthalen-1-ylphenyl)-4-(9,9'-spirobi[fluorene]-2-yl)-1,3-benzothiazole;6-dibenzofuran-4-yl-4-(4-dibenzofuran-4-ylphenyl)-2-ethyl-1,3-benzothiazole;6-(3,5-diphenylphenyl)-2-ethyl-4-[3-(4-pyridin-3-ylphenyl)phenyl]-1,3-benzothiazole
CID 157743916
Benzene;2,5-dimethylfuran;2,5-dimethylselenophene;2,5-dimethyl-[1,3]thiazolo[5,4-d][1,3]thiazole;2,5-dimethylthiophene;ethane;2-methyl-1-benzothiophene;naphthalene;pyridine;2,3,5,6-tetramethylthieno[3,2-b]thiophene;1,2,5-trimethylpyrrole;2,4,5-trimethyl-1,3-thiazole
CID 158293939
Anthracene;benzene;2,5-dimethylfuran;2,5-dimethylselenophene;2,5-dimethylselenopheno[3,2-b]selenophene;2,5-dimethylthieno[3,2-b]thiophene;2,5-dimethylthiophene;ethane;9-methylcarbazole;naphthalene;2,7,9,9-tetramethylfluorene;1,2,5-trimethylpyrrole
CID 158346118
4,6-Bis(4-dibenzofuran-4-ylphenyl)-2-pyridin-3-yl-1,3-benzothiazole;4-dibenzothiophen-2-yl-6-(3-phenylphenyl)-2-(4-phenylphenyl)-1,3-benzothiazole;4-(3-phenylphenyl)-2-(4-phenylphenyl)-6-(9,9'-spirobi[fluorene]-2-yl)-1,3-benzothiazole
CID 158376149
Benzene;but-2-ene;but-2-yne;9,10-dimethylanthracene;9,9-dimethylfluorene;2,5-dimethylfuran;1,5-dimethylnaphthalene;6,13-dimethylpentacene;2,5-dimethylselenophene;5,12-dimethyltetracene;ethane;9-methylcarbazole;pyridine;2,7,12,17-tetramethyl-6,16-dithiapentacyclo[11.7.0.03,11.05,9.015,19]icosa-1,3(11),4,7,9,12,14,17,19-nonaene;2,3,5,6-tetramethylthieno[3,2-b]thiophene;2,4,6,8-tetramethylthieno[2,3-f][1]benzothiole;1,2,5-trimethylpyrrole;2,4,5-trimethyl-1,3-thiazole;2,3,5-trimethylthiophene
CID 158478700
14-(9,9-Dimethylfluoren-2-yl)-3-thiapentacyclo[11.8.0.02,10.04,9.016,21]henicosa-1(13),2(10),4,6,8,11,14,16,18,20-decaene;9-phenyl-3-(3-thiapentacyclo[11.8.0.02,10.04,9.016,21]henicosa-1(13),2(10),4,6,8,11,14,16,18,20-decaen-14-yl)carbazole;1-phenyl-3-(3-thiapentacyclo[11.8.0.02,10.04,9.016,21]henicosa-1(13),2(10),4,6,8,11,14,16,18,20-decaen-14-yl)indole;3-(3-thiapentacyclo[11.8.0.02,10.04,9.016,21]henicosa-1(13),2(10),4,6,8,11,14,16,18,20-decaen-14-yl)furan
CID 158784428
9-(1-Benzofuran-2-yl)-5-dibenzothiophen-3-yl-23-phenyl-27-(2-phenylphenyl)-31-thia-9,27-diazaoctacyclo[15.14.0.02,10.03,8.011,16.018,30.020,28.021,26]hentriaconta-1(17),2(10),3(8),4,6,11,13,15,18(30),19,21(26),22,24,28-tetradecaene;9-(1-benzofuran-2-yl)-5-(9,9-dimethylfluoren-3-yl)-27-(4-methylphenyl)-23-pyridin-3-yl-31-thia-9,27-diazaoctacyclo[15.14.0.02,10.03,8.011,16.018,30.020,28.021,26]hentriaconta-1(17),2(10),3(8),4,6,11,13,15,18(30),19,21(26),22,24,28-tetradecaene
CID 158903034
9-[3-[3-Carbazol-9-yl-5-(6-dibenzothiophen-4-yldibenzofuran-2-yl)phenyl]-5-(6-dibenzothiophen-4-yldibenzofuran-2-yl)phenyl]carbazole;6-[6-[4-(9,9-dimethylfluoren-2-yl)naphthalen-1-yl]-1,9-dimethyl-4-naphthalen-1-yl-8-phenyldibenzothiophen-2-yl]-9-phenylpyrido[3,4-b]indole
CID 158970145

Frequently Asked Questions

What is the IUPAC name of 9,10-dimethylanthracene;9,9-dimethylfluorene;2,5-dimethylfuran;1,5-dimethylnaphthalene;2,5-dimethylselenophene;ethane;9-methylcarbazole;pentacene;pyridine;tetracene;2,7,12,17-tetramethyl-6,16-dithiapentacyclo[11.7.0.03,11.05,9.015,19]icosa-1,3(11),4,7,9,12,14,17,19-nonaene;1,2,4,5-tetramethylpyrrolo[3,4-c]pyrrole-3,6-dione;2,3,5,6-tetramethylthieno[3,2-b]thiophene;2,4,6,8-tetramethylthieno[2,3-f][1]benzothiole;1,2,5-trimethylpyrrole;2,4,5-trimethyl-1,3-thiazole?
The IUPAC name of 9,10-dimethylanthracene;9,9-dimethylfluorene;2,5-dimethylfuran;1,5-dimethylnaphthalene;2,5-dimethylselenophene;ethane;9-methylcarbazole;pentacene;pyridine;tetracene;2,7,12,17-tetramethyl-6,16-dithiapentacyclo[11.7.0.03,11.05,9.015,19]icosa-1,3(11),4,7,9,12,14,17,19-nonaene;1,2,4,5-tetramethylpyrrolo[3,4-c]pyrrole-3,6-dione;2,3,5,6-tetramethylthieno[3,2-b]thiophene;2,4,6,8-tetramethylthieno[2,3-f][1]benzothiole;1,2,5-trimethylpyrrole;2,4,5-trimethyl-1,3-thiazole (CID 158755735) is 9,10-dimethylanthracene;9,9-dimethylfluorene;2,5-dimethylfuran;1,5-dimethylnaphthalene;2,5-dimethylselenophene;ethane;9-methylcarbazole;pentacene;pyridine;tetracene;2,7,12,17-tetramethyl-6,16-dithiapentacyclo[11.7.0.03,11.05,9.015,19]icosa-1,3(11),4,7,9,12,14,17,19-nonaene;1,2,4,5-tetramethylpyrrolo[3,4-c]pyrrole-3,6-dione;2,3,5,6-tetramethylthieno[3,2-b]thiophene;2,4,6,8-tetramethylthieno[2,3-f][1]benzothiole;1,2,5-trimethylpyrrole;2,4,5-trimethyl-1,3-thiazole.
What is the SMILES notation for 9,10-dimethylanthracene;9,9-dimethylfluorene;2,5-dimethylfuran;1,5-dimethylnaphthalene;2,5-dimethylselenophene;ethane;9-methylcarbazole;pentacene;pyridine;tetracene;2,7,12,17-tetramethyl-6,16-dithiapentacyclo[11.7.0.03,11.05,9.015,19]icosa-1,3(11),4,7,9,12,14,17,19-nonaene;1,2,4,5-tetramethylpyrrolo[3,4-c]pyrrole-3,6-dione;2,3,5,6-tetramethylthieno[3,2-b]thiophene;2,4,6,8-tetramethylthieno[2,3-f][1]benzothiole;1,2,5-trimethylpyrrole;2,4,5-trimethyl-1,3-thiazole?
The canonical SMILES for 9,10-dimethylanthracene;9,9-dimethylfluorene;2,5-dimethylfuran;1,5-dimethylnaphthalene;2,5-dimethylselenophene;ethane;9-methylcarbazole;pentacene;pyridine;tetracene;2,7,12,17-tetramethyl-6,16-dithiapentacyclo[11.7.0.03,11.05,9.015,19]icosa-1,3(11),4,7,9,12,14,17,19-nonaene;1,2,4,5-tetramethylpyrrolo[3,4-c]pyrrole-3,6-dione;2,3,5,6-tetramethylthieno[3,2-b]thiophene;2,4,6,8-tetramethylthieno[2,3-f][1]benzothiole;1,2,5-trimethylpyrrole;2,4,5-trimethyl-1,3-thiazole is CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC1(C)c2ccccc2-c2ccccc21.CC1=C2C(=O)N(C)C(C)=C2C(=O)N1C.Cc1c2ccccc2c(C)c2ccccc12.Cc1cc2c(C)c3sc(C)cc3c(C)c2s1.Cc1cc2cc3c(C)c4cc5sc(C)cc5cc4c(C)c3cc2s1.Cc1ccc(C)[se]1.Cc1ccc(C)n1C.Cc1ccc(C)o1.Cc1cccc2c(C)cccc12.Cc1nc(C)c(C)s1.Cc1sc2c(C)c(C)sc2c1C.Cn1c2ccccc2c2ccccc21.c1ccc2cc3cc4cc5ccccc5cc4cc3cc2c1.c1ccc2cc3cc4ccccc4cc3cc2c1.c1ccncc1.
What is the InChIKey of 9,10-dimethylanthracene;9,9-dimethylfluorene;2,5-dimethylfuran;1,5-dimethylnaphthalene;2,5-dimethylselenophene;ethane;9-methylcarbazole;pentacene;pyridine;tetracene;2,7,12,17-tetramethyl-6,16-dithiapentacyclo[11.7.0.03,11.05,9.015,19]icosa-1,3(11),4,7,9,12,14,17,19-nonaene;1,2,4,5-tetramethylpyrrolo[3,4-c]pyrrole-3,6-dione;2,3,5,6-tetramethylthieno[3,2-b]thiophene;2,4,6,8-tetramethylthieno[2,3-f][1]benzothiole;1,2,5-trimethylpyrrole;2,4,5-trimethyl-1,3-thiazole?
The InChIKey is IOAZTSBLSVMTPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H18S2.C22H14.C18H12.C16H14.C15H14.C14H14S2.C13H11N.C12H12.C10H12N2O2.C10H12S2.C7H11N.C6H9NS.C6H8O.C6H8Se.C5H5N.14C2H6/c1-11-5-15-7-17-13(3)20-10-22-16(6-12(2)24-22)8-18(20)14(4)19(17)9-21(15)23-11;1-2-6-16-10-20-14-22-12-18-8-4-3-7-17(18)11-21(22)13-19(20)9-15(16)5-1;1-2-6-14-10-18-12-16-8-4-3-7-15(16)11-17(18)9-13(14)5-1;1-11-13-7-3-5-9-15(13)12(2)16-10-6-4-8-14(11)16;1-15(2)13-9-5-3-7-11(13)12-8-4-6-10-14(12)15;1-7-5-11-9(3)14-12(6-8(2)16-14)10(4)13(11)15-7;1-14-12-8-4-2-6-10(12)11-7-3-5-9-13(11)14;1-9-5-3-8-12-10(2)6-4-7-11(9)12;1-5-7-8(10(14)11(5)3)6(2)12(4)9(7)13;1-5-7(3)11-10-6(2)8(4)12-9(5)10;1-6-4-5-7(2)8(6)3;1-4-5(2)8-6(3)7-4;2*1-5-3-4-6(2)7-5;1-2-4-6-5-3-1;14*1-2/h5-10H,1-4H3;1-14H;1-12H;3-10H,1-2H3;3-10H,1-2H3;5-6H,1-4H3;2-9H,1H3;3-8H,1-2H3;1-4H3;1-4H3;4-5H,1-3H3;1-3H3;2*3-4H,1-2H3;1-5H;14*1-2H3.
What are the key properties of 9,10-dimethylanthracene;9,9-dimethylfluorene;2,5-dimethylfuran;1,5-dimethylnaphthalene;2,5-dimethylselenophene;ethane;9-methylcarbazole;pentacene;pyridine;tetracene;2,7,12,17-tetramethyl-6,16-dithiapentacyclo[11.7.0.03,11.05,9.015,19]icosa-1,3(11),4,7,9,12,14,17,19-nonaene;1,2,4,5-tetramethylpyrrolo[3,4-c]pyrrole-3,6-dione;2,3,5,6-tetramethylthieno[3,2-b]thiophene;2,4,6,8-tetramethylthieno[2,3-f][1]benzothiole;1,2,5-trimethylpyrrole;2,4,5-trimethyl-1,3-thiazole?
9,10-dimethylanthracene;9,9-dimethylfluorene;2,5-dimethylfuran;1,5-dimethylnaphthalene;2,5-dimethylselenophene;ethane;9-methylcarbazole;pentacene;pyridine;tetracene;2,7,12,17-tetramethyl-6,16-dithiapentacyclo[11.7.0.03,11.05,9.015,19]icosa-1,3(11),4,7,9,12,14,17,19-nonaene;1,2,4,5-tetramethylpyrrolo[3,4-c]pyrrole-3,6-dione;2,3,5,6-tetramethylthieno[3,2-b]thiophene;2,4,6,8-tetramethylthieno[2,3-f][1]benzothiole;1,2,5-trimethylpyrrole;2,4,5-trimethyl-1,3-thiazole has a molecular weight of 3217.84 g/mol, XLogP of 66.93, 0 rotatable bonds, 0 hydrogen bond donors, and 14 hydrogen bond acceptors.
Where does this data come from?
All data for 9,10-dimethylanthracene;9,9-dimethylfluorene;2,5-dimethylfuran;1,5-dimethylnaphthalene;2,5-dimethylselenophene;ethane;9-methylcarbazole;pentacene;pyridine;tetracene;2,7,12,17-tetramethyl-6,16-dithiapentacyclo[11.7.0.03,11.05,9.015,19]icosa-1,3(11),4,7,9,12,14,17,19-nonaene;1,2,4,5-tetramethylpyrrolo[3,4-c]pyrrole-3,6-dione;2,3,5,6-tetramethylthieno[3,2-b]thiophene;2,4,6,8-tetramethylthieno[2,3-f][1]benzothiole;1,2,5-trimethylpyrrole;2,4,5-trimethyl-1,3-thiazole is sourced from PubChem (CID 158755735), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).