1-N,4-N-bis(4-methylphenyl)-1-N,4-N-diphenylbenzene-1,4-diamine;4,7-dimethyl-2,1,3-benzothiadiazole;2,7-dimethyl-9,9-dioctylfluorene;1,4-dimethylnaphthalene;2,5-dimethylthiophene;4-methyl-N-(4-methylphenyl)-N-phenylaniline;1-methyl-4-[(E)-prop-1-enyl]benzene;1,2,4-trimethyl-5-octoxybenzene;2,3,7-trimethyl-8-octoxydibenzofuran;2,3,7-trimethyl-8-octoxydibenzothiophene;2,3,7-trimethyl-6-octoxy-9,9-dioctylfluorene

C222H285N5O5S3 — CID 158766578

IUPAC1-N,4-N-bis(4-methylphenyl)-1-N,4-N-diphenylbenzene-1,4-diamine;4,7-dimethyl-2,1,3-benzothiadiazole;2,7-dimethyl-9,9-dioctylfluorene;1,4-dimethylnaphthalene;2,5-dimethylthiophene;4-methyl-N-(4-methylphenyl)-N-phenylaniline;1-methyl-4-[(E)-prop-1-enyl]benzene;1,2,4-trimethyl-5-octoxybenzene;2,3,7-trimethyl-8-octoxydibenzofuran;2,3,7-trimethyl-8-octoxydibenzothiophene;2,3,7-trimethyl-6-octoxy-9,9-dioctylfluorene
SMILESC/C=C/c1ccc(C)cc1.CCCCCCCCC1(CCCCCCCC)c2cc(C)ccc2-c2ccc(C)cc21.CCCCCCCCOc1cc(C)c(C)cc1C.CCCCCCCCOc1cc2c(cc1C)C(CCCCCCCC)(CCCCCCCC)c1cc(C)c(C)cc1-2.CCCCCCCCOc1cc2c(cc1C)oc1cc(C)c(C)cc12.CCCCCCCCOc1cc2c(cc1C)sc1cc(C)c(C)cc12.Cc1ccc(C)c2ccccc12.Cc1ccc(C)c2nsnc12.Cc1ccc(C)s1.Cc1ccc(N(c2ccccc2)c2ccc(C)cc2)cc1.Cc1ccc(N(c2ccccc2)c2ccc(N(c3ccccc3)c3ccc(C)cc3)cc2)cc1
InChIInChI=1S/C40H64O.C32H28N2.C31H46.C23H30O2.C23H30OS.C20H19N.C17H28O.C12H12.C10H12.C8H8N2S.C6H8S/c1-7-10-13-16-19-22-25-40(26-23-20-17-14-11-8-2)37-29-33(5)32(4)28-35(37)36-31-39(34(6)30-38(36)40)41-27-24-21-18-15-12-9-3;1-25-13-17-29(18-14-25)33(27-9-5-3-6-10-27)31-21-23-32(24-22-31)34(28-11-7-4-8-12-28)30-19-15-26(2)16-20-30;1-5-7-9-11-13-15-21-31(22-16-14-12-10-8-6-2)29-23-25(3)17-19-27(29)28-20-18-26(4)24-30(28)31;2*1-5-6-7-8-9-10-11-24-21-15-20-19-12-16(2)17(3)13-22(19)25-23(20)14-18(21)4;1-16-8-12-19(13-9-16)21(18-6-4-3-5-7-18)20-14-10-17(2)11-15-20;1-5-6-7-8-9-10-11-18-17-13-15(3)14(2)12-16(17)4;1-9-7-8-10(2)12-6-4-3-5-11(9)12;1-3-4-10-7-5-9(2)6-8-10;1-5-3-4-6(2)8-7(5)9-11-10-8;1-5-3-4-6(2)7-5/h28-31H,7-27H2,1-6H3;3-24H,1-2H3;17-20,23-24H,5-16,21-22H2,1-4H3;2*12-15H,5-11H2,1-4H3;3-15H,1-2H3;12-13H,5-11H2,1-4H3;3-8H,1-2H3;3-8H,1-2H3;3-4H,1-2H3;3-4H,1-2H3/b;;;;;;;;4-3+;;
InChIKeyIPIJWYZNUJLUOL-MESHHVKQSA-N
MW3199.95 g/mol
LogP69.68
Rot. Bonds70

About 1-N,4-N-bis(4-methylphenyl)-1-N,4-N-diphenylbenzene-1,4-diamine;4,7-dimethyl-2,1,3-benzothiadiazole;2,7-dimethyl-9,9-dioctylfluorene;1,4-dimethylnaphthalene;2,5-dimethylthiophene;4-methyl-N-(4-methylphenyl)-N-phenylaniline;1-methyl-4-[(E)-prop-1-enyl]benzene;1,2,4-trimethyl-5-octoxybenzene;2,3,7-trimethyl-8-octoxydibenzofuran;2,3,7-trimethyl-8-octoxydibenzothiophene;2,3,7-trimethyl-6-octoxy-9,9-dioctylfluorene

1-N,4-N-bis(4-methylphenyl)-1-N,4-N-diphenylbenzene-1,4-diamine;4,7-dimethyl-2,1,3-benzothiadiazole;2,7-dimethyl-9,9-dioctylfluorene;1,4-dimethylnaphthalene;2,5-dimethylthiophene;4-methyl-N-(4-methylphenyl)-N-phenylaniline;1-methyl-4-[(E)-prop-1-enyl]benzene;1,2,4-trimethyl-5-octoxybenzene;2,3,7-trimethyl-8-octoxydibenzofuran;2,3,7-trimethyl-8-octoxydibenzothiophene;2,3,7-trimethyl-6-octoxy-9,9-dioctylfluorene (PubChem CID 158766578) has the molecular formula C222H285N5O5S3 and a molecular weight of 3199.95 g/mol. Its IUPAC name is 1-N,4-N-bis(4-methylphenyl)-1-N,4-N-diphenylbenzene-1,4-diamine;4,7-dimethyl-2,1,3-benzothiadiazole;2,7-dimethyl-9,9-dioctylfluorene;1,4-dimethylnaphthalene;2,5-dimethylthiophene;4-methyl-N-(4-methylphenyl)-N-phenylaniline;1-methyl-4-[(E)-prop-1-enyl]benzene;1,2,4-trimethyl-5-octoxybenzene;2,3,7-trimethyl-8-octoxydibenzofuran;2,3,7-trimethyl-8-octoxydibenzothiophene;2,3,7-trimethyl-6-octoxy-9,9-dioctylfluorene.

Molecular Properties

Compound Name1-N,4-N-bis(4-methylphenyl)-1-N,4-N-diphenylbenzene-1,4-diamine;4,7-dimethyl-2,1,3-benzothiadiazole;2,7-dimethyl-9,9-dioctylfluorene;1,4-dimethylnaphthalene;2,5-dimethylthiophene;4-methyl-N-(4-methylphenyl)-N-phenylaniline;1-methyl-4-[(E)-prop-1-enyl]benzene;1,2,4-trimethyl-5-octoxybenzene;2,3,7-trimethyl-8-octoxydibenzofuran;2,3,7-trimethyl-8-octoxydibenzothiophene;2,3,7-trimethyl-6-octoxy-9,9-dioctylfluorene
PubChem CID158766578
Molecular FormulaC222H285N5O5S3
Molecular Weight3199.95 g/mol
Exact Mass3197.14
IUPAC Name1-N,4-N-bis(4-methylphenyl)-1-N,4-N-diphenylbenzene-1,4-diamine;4,7-dimethyl-2,1,3-benzothiadiazole;2,7-dimethyl-9,9-dioctylfluorene;1,4-dimethylnaphthalene;2,5-dimethylthiophene;4-methyl-N-(4-methylphenyl)-N-phenylaniline;1-methyl-4-[(E)-prop-1-enyl]benzene;1,2,4-trimethyl-5-octoxybenzene;2,3,7-trimethyl-8-octoxydibenzofuran;2,3,7-trimethyl-8-octoxydibenzothiophene;2,3,7-trimethyl-6-octoxy-9,9-dioctylfluorene
SMILESC/C=C/c1ccc(C)cc1.CCCCCCCCC1(CCCCCCCC)c2cc(C)ccc2-c2ccc(C)cc21.CCCCCCCCOc1cc(C)c(C)cc1C.CCCCCCCCOc1cc2c(cc1C)C(CCCCCCCC)(CCCCCCCC)c1cc(C)c(C)cc1-2.CCCCCCCCOc1cc2c(cc1C)oc1cc(C)c(C)cc12.CCCCCCCCOc1cc2c(cc1C)sc1cc(C)c(C)cc12.Cc1ccc(C)c2ccccc12.Cc1ccc(C)c2nsnc12.Cc1ccc(C)s1.Cc1ccc(N(c2ccccc2)c2ccc(C)cc2)cc1.Cc1ccc(N(c2ccccc2)c2ccc(N(c3ccccc3)c3ccc(C)cc3)cc2)cc1
InChIInChI=1S/C40H64O.C32H28N2.C31H46.C23H30O2.C23H30OS.C20H19N.C17H28O.C12H12.C10H12.C8H8N2S.C6H8S/c1-7-10-13-16-19-22-25-40(26-23-20-17-14-11-8-2)37-29-33(5)32(4)28-35(37)36-31-39(34(6)30-38(36)40)41-27-24-21-18-15-12-9-3;1-25-13-17-29(18-14-25)33(27-9-5-3-6-10-27)31-21-23-32(24-22-31)34(28-11-7-4-8-12-28)30-19-15-26(2)16-20-30;1-5-7-9-11-13-15-21-31(22-16-14-12-10-8-6-2)29-23-25(3)17-19-27(29)28-20-18-26(4)24-30(28)31;2*1-5-6-7-8-9-10-11-24-21-15-20-19-12-16(2)17(3)13-22(19)25-23(20)14-18(21)4;1-16-8-12-19(13-9-16)21(18-6-4-3-5-7-18)20-14-10-17(2)11-15-20;1-5-6-7-8-9-10-11-18-17-13-15(3)14(2)12-16(17)4;1-9-7-8-10(2)12-6-4-3-5-11(9)12;1-3-4-10-7-5-9(2)6-8-10;1-5-3-4-6(2)8-7(5)9-11-10-8;1-5-3-4-6(2)7-5/h28-31H,7-27H2,1-6H3;3-24H,1-2H3;17-20,23-24H,5-16,21-22H2,1-4H3;2*12-15H,5-11H2,1-4H3;3-15H,1-2H3;12-13H,5-11H2,1-4H3;3-8H,1-2H3;3-8H,1-2H3;3-4H,1-2H3;3-4H,1-2H3/b;;;;;;;;4-3+;;
InChIKeyIPIJWYZNUJLUOL-MESHHVKQSA-N
XLogP69.68
TPSA85.56 Ų
H-Bond Donors
H-Bond Acceptors13
Rotatable Bonds70
Heavy Atoms235
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003199.95
LogP ≤ 569.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1013

Computed Properties (RDKit)

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

Analyze 1-N,4-N-bis(4-methylphenyl)-1-N,4-N-diphenylbenzene-1,4-diamine;4,7-dimethyl-2,1,3-benzothiadiazole;2,7-dimethyl-9,9-dioctylfluorene;1,4-dimethylnaphthalene;2,5-dimethylthiophene;4-methyl-N-(4-methylphenyl)-N-phenylaniline;1-methyl-4-[(E)-prop-1-enyl]benzene;1,2,4-trimethyl-5-octoxybenzene;2,3,7-trimethyl-8-octoxydibenzofuran;2,3,7-trimethyl-8-octoxydibenzothiophene;2,3,7-trimethyl-6-octoxy-9,9-dioctylfluorene with MolForge

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Related Compounds

4,7-Dimethyl-2,1,3-benzothiadiazole;2,3,7-trimethyl-8-octoxydibenzofuran;2,3,7-trimethyl-8-octoxydibenzothiophene
CID 90703990
N-[4-(7,7-dimethylfluoreno[4,3-b][1]benzofuran-1-yl)phenyl]-7-[4-[4-[N-[4-[2-[4-[4-[N-(9,9-dimethylfluoren-2-yl)-4-(9-phenylcarbazol-3-yl)anilino]phenyl]dibenzothiophen-1-yl]dibenzofuran-4-yl]phenyl]-4-(4-phenylphenyl)anilino]phenyl]dibenzofuran-2-yl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine
CID 126695210
N-[4-(7,7-dimethylfluoreno[4,3-b][1]benzofuran-1-yl)phenyl]-7-[4-[4-[N-[4-[2-[4-[4-[N-(9,9-dimethylfluoren-2-yl)-4-(9-phenylcarbazol-3-yl)anilino]phenyl]dibenzothiophen-1-yl]dibenzofuran-4-yl]phenyl]-4-(4-phenylphenyl)anilino]phenyl]dibenzofuran-1-yl]-9,9-dimethyl-N-(4-phenylphenyl)fluoren-2-amine
CID 139492144
20,20-Dimethyl-3-phenyl-3-azaoctacyclo[13.13.2.02,10.04,9.011,30.018,29.019,27.021,26]triaconta-1(28),2(10),4,6,8,11,13,15(30),16,18(29),19(27),21,23,25-tetradecaene;3,20-dioxaoctacyclo[13.13.2.02,10.04,9.011,30.018,29.019,27.021,26]triaconta-1(29),2(10),4,6,8,11,13,15(30),16,18,21,23,25,27-tetradecaene;3,20-dithiaoctacyclo[13.13.2.02,10.04,9.011,30.018,29.019,27.021,26]triaconta-1(29),2(10),4,6,8,11,13,15(30),16,18,21,23,25,27-tetradecaene
CID 144531084
6-(34,34-Dimethyl-9-oxa-14-thiadecacyclo[20.13.2.02,10.03,8.011,37.013,21.015,20.025,36.027,35.028,33]heptatriaconta-1(36),2(10),3,5,7,11,13(21),15,17,19,22(37),23,25,27(35),28(33),29,31-heptadecaen-31-yl)-9,9-dimethyl-14,33-diphenyl-14,33-diazanonacyclo[22.11.0.02,10.03,8.011,23.013,21.015,20.026,34.027,32]pentatriaconta-1,3(8),4,6,10,12,15,17,19,21,23,25,27,29,31,34-hexadecaene
CID 146262337
CID 157234807
CID 157234807
11-(4-Dibenzofuran-2-ylphenyl)-5-phenylindolo[3,2-b]carbazole;11-(4-dibenzofuran-3-ylphenyl)-5-phenylindolo[3,2-b]carbazole;11-(4-dibenzothiophen-2-ylphenyl)-5-phenylindolo[3,2-b]carbazole;11-(4-dibenzothiophen-3-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 157240146
2-[10-(9,9-Dimethylfluoren-2-yl)anthracen-9-yl]dibenzofuran;1-[10-(3,5-diphenylphenyl)anthracen-9-yl]dibenzothiophene;2-(10-naphthalen-1-ylanthracen-9-yl)dibenzofuran;2-(10-naphthalen-2-ylanthracen-9-yl)dibenzothiophene;1-[10-(4-naphthalen-1-ylphenyl)anthracen-9-yl]dibenzofuran;4-[10-(3-naphthalen-1-ylphenyl)anthracen-9-yl]dibenzofuran;3-(10-phenanthren-9-ylanthracen-9-yl)-9-(3-phenylphenyl)carbazole;9-[4-(10-phenylanthracen-9-yl)phenyl]carbazole;4-[10-(4-phenylnaphthalen-1-yl)anthracen-9-yl]dibenzothiophene;9-phenyl-2-[10-(4-phenylphenyl)anthracen-9-yl]carbazole
CID 157296217
3-Dibenzothiophen-2-yl-9-(7,7-dimethylfluoreno[5,6-b][1]benzofuran-9-yl)-6-phenylcarbazole;3-dibenzothiophen-2-yl-9-(12,12-dimethylfluoreno[2,1-b][1]benzofuran-10-yl)-6-phenylcarbazole;3-dibenzothiophen-4-yl-9-(7,7-dimethylfluoreno[5,6-b][1]benzofuran-9-yl)-6-phenylcarbazole;3-dibenzothiophen-4-yl-9-(7,7-dimethylfluoreno[5,6-b][1]benzothiol-9-yl)-6-phenylcarbazole
CID 157299796
1,2-Dimethyldibenzofuran;bis(1,9-dimethyldibenzofuran);1,2-dimethyldibenzothiophene;1,9-dimethyldibenzothiophene;3,4-dimethyl-9-phenylcarbazole;4,5-dimethyl-9-phenylcarbazole;4,5,9,9-tetramethylfluorene
CID 157347388
4-dibenzofuran-4-yl-N-(4-dibenzofuran-4-ylphenyl)-N-[4-(3,5-diphenylphenyl)phenyl]aniline;N-(4-dibenzofuran-2-ylphenyl)-9,9-dimethyl-N-naphthalen-1-yl-7-(9-phenylcarbazol-3-yl)fluoren-2-amine;4-dibenzothiophen-4-yl-N-(4-dibenzothiophen-4-ylphenyl)-N-phenylaniline;N-(4-dibenzothiophen-4-ylphenyl)-4-phenyl-N-(4-phenylphenyl)aniline
CID 157369450
9-(10-Dibenzofuran-2-ylanthracen-9-yl)naphtho[1,2-b][1]benzofuran;9-(10-dibenzofuran-3-ylanthracen-9-yl)naphtho[1,2-b][1]benzofuran;9-(10-dibenzofuran-4-ylanthracen-9-yl)naphtho[1,2-b][1]benzofuran;9-(10-dibenzothiophen-2-ylanthracen-9-yl)naphtho[1,2-b][1]benzofuran;9-[10-(7,7-dimethylbenzo[c]fluoren-5-yl)anthracen-9-yl]naphtho[1,2-b][1]benzofuran;9-[10-(7,7-dimethylbenzo[g]fluoren-9-yl)anthracen-9-yl]naphtho[1,2-b][1]benzofuran;3-(10-naphtho[1,2-b][1]benzofuran-9-ylanthracen-9-yl)-9-phenylcarbazole
CID 157491732

Frequently Asked Questions

What is the IUPAC name of 1-N,4-N-bis(4-methylphenyl)-1-N,4-N-diphenylbenzene-1,4-diamine;4,7-dimethyl-2,1,3-benzothiadiazole;2,7-dimethyl-9,9-dioctylfluorene;1,4-dimethylnaphthalene;2,5-dimethylthiophene;4-methyl-N-(4-methylphenyl)-N-phenylaniline;1-methyl-4-[(E)-prop-1-enyl]benzene;1,2,4-trimethyl-5-octoxybenzene;2,3,7-trimethyl-8-octoxydibenzofuran;2,3,7-trimethyl-8-octoxydibenzothiophene;2,3,7-trimethyl-6-octoxy-9,9-dioctylfluorene?
The IUPAC name of 1-N,4-N-bis(4-methylphenyl)-1-N,4-N-diphenylbenzene-1,4-diamine;4,7-dimethyl-2,1,3-benzothiadiazole;2,7-dimethyl-9,9-dioctylfluorene;1,4-dimethylnaphthalene;2,5-dimethylthiophene;4-methyl-N-(4-methylphenyl)-N-phenylaniline;1-methyl-4-[(E)-prop-1-enyl]benzene;1,2,4-trimethyl-5-octoxybenzene;2,3,7-trimethyl-8-octoxydibenzofuran;2,3,7-trimethyl-8-octoxydibenzothiophene;2,3,7-trimethyl-6-octoxy-9,9-dioctylfluorene (CID 158766578) is 1-N,4-N-bis(4-methylphenyl)-1-N,4-N-diphenylbenzene-1,4-diamine;4,7-dimethyl-2,1,3-benzothiadiazole;2,7-dimethyl-9,9-dioctylfluorene;1,4-dimethylnaphthalene;2,5-dimethylthiophene;4-methyl-N-(4-methylphenyl)-N-phenylaniline;1-methyl-4-[(E)-prop-1-enyl]benzene;1,2,4-trimethyl-5-octoxybenzene;2,3,7-trimethyl-8-octoxydibenzofuran;2,3,7-trimethyl-8-octoxydibenzothiophene;2,3,7-trimethyl-6-octoxy-9,9-dioctylfluorene.
What is the SMILES notation for 1-N,4-N-bis(4-methylphenyl)-1-N,4-N-diphenylbenzene-1,4-diamine;4,7-dimethyl-2,1,3-benzothiadiazole;2,7-dimethyl-9,9-dioctylfluorene;1,4-dimethylnaphthalene;2,5-dimethylthiophene;4-methyl-N-(4-methylphenyl)-N-phenylaniline;1-methyl-4-[(E)-prop-1-enyl]benzene;1,2,4-trimethyl-5-octoxybenzene;2,3,7-trimethyl-8-octoxydibenzofuran;2,3,7-trimethyl-8-octoxydibenzothiophene;2,3,7-trimethyl-6-octoxy-9,9-dioctylfluorene?
The canonical SMILES for 1-N,4-N-bis(4-methylphenyl)-1-N,4-N-diphenylbenzene-1,4-diamine;4,7-dimethyl-2,1,3-benzothiadiazole;2,7-dimethyl-9,9-dioctylfluorene;1,4-dimethylnaphthalene;2,5-dimethylthiophene;4-methyl-N-(4-methylphenyl)-N-phenylaniline;1-methyl-4-[(E)-prop-1-enyl]benzene;1,2,4-trimethyl-5-octoxybenzene;2,3,7-trimethyl-8-octoxydibenzofuran;2,3,7-trimethyl-8-octoxydibenzothiophene;2,3,7-trimethyl-6-octoxy-9,9-dioctylfluorene is C/C=C/c1ccc(C)cc1.CCCCCCCCC1(CCCCCCCC)c2cc(C)ccc2-c2ccc(C)cc21.CCCCCCCCOc1cc(C)c(C)cc1C.CCCCCCCCOc1cc2c(cc1C)C(CCCCCCCC)(CCCCCCCC)c1cc(C)c(C)cc1-2.CCCCCCCCOc1cc2c(cc1C)oc1cc(C)c(C)cc12.CCCCCCCCOc1cc2c(cc1C)sc1cc(C)c(C)cc12.Cc1ccc(C)c2ccccc12.Cc1ccc(C)c2nsnc12.Cc1ccc(C)s1.Cc1ccc(N(c2ccccc2)c2ccc(C)cc2)cc1.Cc1ccc(N(c2ccccc2)c2ccc(N(c3ccccc3)c3ccc(C)cc3)cc2)cc1.
What is the InChIKey of 1-N,4-N-bis(4-methylphenyl)-1-N,4-N-diphenylbenzene-1,4-diamine;4,7-dimethyl-2,1,3-benzothiadiazole;2,7-dimethyl-9,9-dioctylfluorene;1,4-dimethylnaphthalene;2,5-dimethylthiophene;4-methyl-N-(4-methylphenyl)-N-phenylaniline;1-methyl-4-[(E)-prop-1-enyl]benzene;1,2,4-trimethyl-5-octoxybenzene;2,3,7-trimethyl-8-octoxydibenzofuran;2,3,7-trimethyl-8-octoxydibenzothiophene;2,3,7-trimethyl-6-octoxy-9,9-dioctylfluorene?
The InChIKey is IPIJWYZNUJLUOL-MESHHVKQSA-N. The full InChI is InChI=1S/C40H64O.C32H28N2.C31H46.C23H30O2.C23H30OS.C20H19N.C17H28O.C12H12.C10H12.C8H8N2S.C6H8S/c1-7-10-13-16-19-22-25-40(26-23-20-17-14-11-8-2)37-29-33(5)32(4)28-35(37)36-31-39(34(6)30-38(36)40)41-27-24-21-18-15-12-9-3;1-25-13-17-29(18-14-25)33(27-9-5-3-6-10-27)31-21-23-32(24-22-31)34(28-11-7-4-8-12-28)30-19-15-26(2)16-20-30;1-5-7-9-11-13-15-21-31(22-16-14-12-10-8-6-2)29-23-25(3)17-19-27(29)28-20-18-26(4)24-30(28)31;2*1-5-6-7-8-9-10-11-24-21-15-20-19-12-16(2)17(3)13-22(19)25-23(20)14-18(21)4;1-16-8-12-19(13-9-16)21(18-6-4-3-5-7-18)20-14-10-17(2)11-15-20;1-5-6-7-8-9-10-11-18-17-13-15(3)14(2)12-16(17)4;1-9-7-8-10(2)12-6-4-3-5-11(9)12;1-3-4-10-7-5-9(2)6-8-10;1-5-3-4-6(2)8-7(5)9-11-10-8;1-5-3-4-6(2)7-5/h28-31H,7-27H2,1-6H3;3-24H,1-2H3;17-20,23-24H,5-16,21-22H2,1-4H3;2*12-15H,5-11H2,1-4H3;3-15H,1-2H3;12-13H,5-11H2,1-4H3;3-8H,1-2H3;3-8H,1-2H3;3-4H,1-2H3;3-4H,1-2H3/b;;;;;;;;4-3+;;.
What are the key properties of 1-N,4-N-bis(4-methylphenyl)-1-N,4-N-diphenylbenzene-1,4-diamine;4,7-dimethyl-2,1,3-benzothiadiazole;2,7-dimethyl-9,9-dioctylfluorene;1,4-dimethylnaphthalene;2,5-dimethylthiophene;4-methyl-N-(4-methylphenyl)-N-phenylaniline;1-methyl-4-[(E)-prop-1-enyl]benzene;1,2,4-trimethyl-5-octoxybenzene;2,3,7-trimethyl-8-octoxydibenzofuran;2,3,7-trimethyl-8-octoxydibenzothiophene;2,3,7-trimethyl-6-octoxy-9,9-dioctylfluorene?
1-N,4-N-bis(4-methylphenyl)-1-N,4-N-diphenylbenzene-1,4-diamine;4,7-dimethyl-2,1,3-benzothiadiazole;2,7-dimethyl-9,9-dioctylfluorene;1,4-dimethylnaphthalene;2,5-dimethylthiophene;4-methyl-N-(4-methylphenyl)-N-phenylaniline;1-methyl-4-[(E)-prop-1-enyl]benzene;1,2,4-trimethyl-5-octoxybenzene;2,3,7-trimethyl-8-octoxydibenzofuran;2,3,7-trimethyl-8-octoxydibenzothiophene;2,3,7-trimethyl-6-octoxy-9,9-dioctylfluorene has a molecular weight of 3199.95 g/mol, XLogP of 69.68, 70 rotatable bonds, 0 hydrogen bond donors, and 13 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N,4-N-bis(4-methylphenyl)-1-N,4-N-diphenylbenzene-1,4-diamine;4,7-dimethyl-2,1,3-benzothiadiazole;2,7-dimethyl-9,9-dioctylfluorene;1,4-dimethylnaphthalene;2,5-dimethylthiophene;4-methyl-N-(4-methylphenyl)-N-phenylaniline;1-methyl-4-[(E)-prop-1-enyl]benzene;1,2,4-trimethyl-5-octoxybenzene;2,3,7-trimethyl-8-octoxydibenzofuran;2,3,7-trimethyl-8-octoxydibenzothiophene;2,3,7-trimethyl-6-octoxy-9,9-dioctylfluorene is sourced from PubChem (CID 158766578), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).