6-[(9E)-9-[cyano(isocyano)methylidene]-6-(2,3-diisocyanoquinoxalin-6-yl)-7-methyl-2-(trifluoromethoxy)fluoren-3-yl]quinoxaline-2,3-dicarbonitrile;(2E)-2-isocyano-2-[2-methyl-3,6-bis(4-octylphenyl)-7-(trifluoromethoxy)fluoren-9-ylidene]acetonitrile;(2E)-2-isocyano-2-[2-methyl-3,6-bis(2,3,5,6-tetrafluoro-4-pyridinyl)-7-(trifluoromethoxy)fluoren-9-ylidene]acetonitrile;2-isocyano-2-[2-methyl-3,6-dipyridin-2-yl-7-(trifluoromethoxy)-9H-fluoren-9-yl]acetonitrile;(2E)-2-isocyano-2-[2-methyl-3,6-dipyridin-4-yl-7-(trifluoromethoxy)fluoren-9-ylidene]acetonitrile;(2E)-2-isocyano-2-[2-methyl-7-(trifluoromethoxy)-3,6-bis(4-trimethylsilylphenyl)fluoren-9-ylidene]acetonitrile

C204H134F26N26O6Si2 — CID 160609681

IUPAC6-[(9E)-9-[cyano(isocyano)methylidene]-6-(2,3-diisocyanoquinoxalin-6-yl)-7-methyl-2-(trifluoromethoxy)fluoren-3-yl]quinoxaline-2,3-dicarbonitrile;(2E)-2-isocyano-2-[2-methyl-3,6-bis(4-octylphenyl)-7-(trifluoromethoxy)fluoren-9-ylidene]acetonitrile;(2E)-2-isocyano-2-[2-methyl-3,6-bis(2,3,5,6-tetrafluoro-4-pyridinyl)-7-(trifluoromethoxy)fluoren-9-ylidene]acetonitrile;2-isocyano-2-[2-methyl-3,6-dipyridin-2-yl-7-(trifluoromethoxy)-9H-fluoren-9-yl]acetonitrile;(2E)-2-isocyano-2-[2-methyl-3,6-dipyridin-4-yl-7-(trifluoromethoxy)fluoren-9-ylidene]acetonitrile;(2E)-2-isocyano-2-[2-methyl-7-(trifluoromethoxy)-3,6-bis(4-trimethylsilylphenyl)fluoren-9-ylidene]acetonitrile
SMILES[C-]#[N+]/C(C#N)=C1\c2cc(C)c(-c3c(F)c(F)nc(F)c3F)cc2-c2cc(-c3c(F)c(F)nc(F)c3F)c(OC(F)(F)F)cc21.[C-]#[N+]/C(C#N)=C1\c2cc(C)c(-c3ccc(CCCCCCCC)cc3)cc2-c2cc(-c3ccc(CCCCCCCC)cc3)c(OC(F)(F)F)cc21.[C-]#[N+]/C(C#N)=C1\c2cc(C)c(-c3ccc([Si](C)(C)C)cc3)cc2-c2cc(-c3ccc([Si](C)(C)C)cc3)c(OC(F)(F)F)cc21.[C-]#[N+]/C(C#N)=C1\c2cc(C)c(-c3ccc4nc([N+]#[C-])c([N+]#[C-])nc4c3)cc2-c2cc(-c3ccc4nc(C#N)c(C#N)nc4c3)c(OC(F)(F)F)cc21.[C-]#[N+]/C(C#N)=C1\c2cc(C)c(-c3ccncc3)cc2-c2cc(-c3ccncc3)c(OC(F)(F)F)cc21.[C-]#[N+]C(C#N)C1c2cc(C)c(-c3ccccn3)cc2-c2cc(-c3ccccn3)c(OC(F)(F)F)cc21
InChIInChI=1S/C46H49F3N2O.C38H13F3N10O.C36H33F3N2OSi2.C28H7F11N4O.C28H15F3N4O.C28H17F3N4O/c1-5-7-9-11-13-15-17-33-19-23-35(24-20-33)37-28-39-40-29-38(36-25-21-34(22-26-36)18-16-14-12-10-8-6-2)44(52-46(47,48)49)30-42(40)45(43(31-50)51-4)41(39)27-32(37)3;1-18-9-25-23(12-21(18)19-5-8-28-30(10-19)51-37(47-4)36(46-3)50-28)24-13-22(20-6-7-27-29(11-20)49-32(16-43)31(15-42)48-27)34(52-38(39,40)41)14-26(24)35(25)33(17-44)45-2;1-22-17-31-29(18-27(22)23-9-13-25(14-10-23)43(3,4)5)30-19-28(24-11-15-26(16-12-24)44(6,7)8)34(42-36(37,38)39)20-32(30)35(31)33(21-40)41-2;1-8-3-12-10(4-9(8)18-20(29)24(33)42-25(34)21(18)30)11-5-14(19-22(31)26(35)43-27(36)23(19)32)16(44-28(37,38)39)6-13(11)17(12)15(7-40)41-2;1-16-11-23-21(12-19(16)17-3-7-34-8-4-17)22-13-20(18-5-9-35-10-6-18)26(36-28(29,30)31)14-24(22)27(23)25(15-32)33-2;1-16-11-20-18(12-17(16)23-7-3-5-9-34-23)19-13-22(24-8-4-6-10-35-24)26(36-28(29,30)31)14-21(19)27(20)25(15-32)33-2/h19-30H,5-18H2,1-3H3;5-14H,1H3;9-20H,1,3-8H3;3-6H,1H3;3-14H,1H3;3-14,25,27H,1H3/b45-43+;2*35-33+;17-15+;27-25+;
InChIKeyRFISEWQEUKLSLP-VVNNZXMASA-N
MW3595.61 g/mol
LogP55.31
Rot. Bonds35

About 6-[(9E)-9-[cyano(isocyano)methylidene]-6-(2,3-diisocyanoquinoxalin-6-yl)-7-methyl-2-(trifluoromethoxy)fluoren-3-yl]quinoxaline-2,3-dicarbonitrile;(2E)-2-isocyano-2-[2-methyl-3,6-bis(4-octylphenyl)-7-(trifluoromethoxy)fluoren-9-ylidene]acetonitrile;(2E)-2-isocyano-2-[2-methyl-3,6-bis(2,3,5,6-tetrafluoro-4-pyridinyl)-7-(trifluoromethoxy)fluoren-9-ylidene]acetonitrile;2-isocyano-2-[2-methyl-3,6-dipyridin-2-yl-7-(trifluoromethoxy)-9H-fluoren-9-yl]acetonitrile;(2E)-2-isocyano-2-[2-methyl-3,6-dipyridin-4-yl-7-(trifluoromethoxy)fluoren-9-ylidene]acetonitrile;(2E)-2-isocyano-2-[2-methyl-7-(trifluoromethoxy)-3,6-bis(4-trimethylsilylphenyl)fluoren-9-ylidene]acetonitrile

6-[(9E)-9-[cyano(isocyano)methylidene]-6-(2,3-diisocyanoquinoxalin-6-yl)-7-methyl-2-(trifluoromethoxy)fluoren-3-yl]quinoxaline-2,3-dicarbonitrile;(2E)-2-isocyano-2-[2-methyl-3,6-bis(4-octylphenyl)-7-(trifluoromethoxy)fluoren-9-ylidene]acetonitrile;(2E)-2-isocyano-2-[2-methyl-3,6-bis(2,3,5,6-tetrafluoro-4-pyridinyl)-7-(trifluoromethoxy)fluoren-9-ylidene]acetonitrile;2-isocyano-2-[2-methyl-3,6-dipyridin-2-yl-7-(trifluoromethoxy)-9H-fluoren-9-yl]acetonitrile;(2E)-2-isocyano-2-[2-methyl-3,6-dipyridin-4-yl-7-(trifluoromethoxy)fluoren-9-ylidene]acetonitrile;(2E)-2-isocyano-2-[2-methyl-7-(trifluoromethoxy)-3,6-bis(4-trimethylsilylphenyl)fluoren-9-ylidene]acetonitrile (PubChem CID 160609681) has the molecular formula C204H134F26N26O6Si2 and a molecular weight of 3595.61 g/mol. Its IUPAC name is 6-[(9E)-9-[cyano(isocyano)methylidene]-6-(2,3-diisocyanoquinoxalin-6-yl)-7-methyl-2-(trifluoromethoxy)fluoren-3-yl]quinoxaline-2,3-dicarbonitrile;(2E)-2-isocyano-2-[2-methyl-3,6-bis(4-octylphenyl)-7-(trifluoromethoxy)fluoren-9-ylidene]acetonitrile;(2E)-2-isocyano-2-[2-methyl-3,6-bis(2,3,5,6-tetrafluoro-4-pyridinyl)-7-(trifluoromethoxy)fluoren-9-ylidene]acetonitrile;2-isocyano-2-[2-methyl-3,6-dipyridin-2-yl-7-(trifluoromethoxy)-9H-fluoren-9-yl]acetonitrile;(2E)-2-isocyano-2-[2-methyl-3,6-dipyridin-4-yl-7-(trifluoromethoxy)fluoren-9-ylidene]acetonitrile;(2E)-2-isocyano-2-[2-methyl-7-(trifluoromethoxy)-3,6-bis(4-trimethylsilylphenyl)fluoren-9-ylidene]acetonitrile.

Molecular Properties

Compound Name6-[(9E)-9-[cyano(isocyano)methylidene]-6-(2,3-diisocyanoquinoxalin-6-yl)-7-methyl-2-(trifluoromethoxy)fluoren-3-yl]quinoxaline-2,3-dicarbonitrile;(2E)-2-isocyano-2-[2-methyl-3,6-bis(4-octylphenyl)-7-(trifluoromethoxy)fluoren-9-ylidene]acetonitrile;(2E)-2-isocyano-2-[2-methyl-3,6-bis(2,3,5,6-tetrafluoro-4-pyridinyl)-7-(trifluoromethoxy)fluoren-9-ylidene]acetonitrile;2-isocyano-2-[2-methyl-3,6-dipyridin-2-yl-7-(trifluoromethoxy)-9H-fluoren-9-yl]acetonitrile;(2E)-2-isocyano-2-[2-methyl-3,6-dipyridin-4-yl-7-(trifluoromethoxy)fluoren-9-ylidene]acetonitrile;(2E)-2-isocyano-2-[2-methyl-7-(trifluoromethoxy)-3,6-bis(4-trimethylsilylphenyl)fluoren-9-ylidene]acetonitrile
PubChem CID160609681
Molecular FormulaC204H134F26N26O6Si2
Molecular Weight3595.61 g/mol
Exact Mass3593.01
IUPAC Name6-[(9E)-9-[cyano(isocyano)methylidene]-6-(2,3-diisocyanoquinoxalin-6-yl)-7-methyl-2-(trifluoromethoxy)fluoren-3-yl]quinoxaline-2,3-dicarbonitrile;(2E)-2-isocyano-2-[2-methyl-3,6-bis(4-octylphenyl)-7-(trifluoromethoxy)fluoren-9-ylidene]acetonitrile;(2E)-2-isocyano-2-[2-methyl-3,6-bis(2,3,5,6-tetrafluoro-4-pyridinyl)-7-(trifluoromethoxy)fluoren-9-ylidene]acetonitrile;2-isocyano-2-[2-methyl-3,6-dipyridin-2-yl-7-(trifluoromethoxy)-9H-fluoren-9-yl]acetonitrile;(2E)-2-isocyano-2-[2-methyl-3,6-dipyridin-4-yl-7-(trifluoromethoxy)fluoren-9-ylidene]acetonitrile;(2E)-2-isocyano-2-[2-methyl-7-(trifluoromethoxy)-3,6-bis(4-trimethylsilylphenyl)fluoren-9-ylidene]acetonitrile
SMILES[C-]#[N+]/C(C#N)=C1\c2cc(C)c(-c3c(F)c(F)nc(F)c3F)cc2-c2cc(-c3c(F)c(F)nc(F)c3F)c(OC(F)(F)F)cc21.[C-]#[N+]/C(C#N)=C1\c2cc(C)c(-c3ccc(CCCCCCCC)cc3)cc2-c2cc(-c3ccc(CCCCCCCC)cc3)c(OC(F)(F)F)cc21.[C-]#[N+]/C(C#N)=C1\c2cc(C)c(-c3ccc([Si](C)(C)C)cc3)cc2-c2cc(-c3ccc([Si](C)(C)C)cc3)c(OC(F)(F)F)cc21.[C-]#[N+]/C(C#N)=C1\c2cc(C)c(-c3ccc4nc([N+]#[C-])c([N+]#[C-])nc4c3)cc2-c2cc(-c3ccc4nc(C#N)c(C#N)nc4c3)c(OC(F)(F)F)cc21.[C-]#[N+]/C(C#N)=C1\c2cc(C)c(-c3ccncc3)cc2-c2cc(-c3ccncc3)c(OC(F)(F)F)cc21.[C-]#[N+]C(C#N)C1c2cc(C)c(-c3ccccn3)cc2-c2cc(-c3ccccn3)c(OC(F)(F)F)cc21
InChIInChI=1S/C46H49F3N2O.C38H13F3N10O.C36H33F3N2OSi2.C28H7F11N4O.C28H15F3N4O.C28H17F3N4O/c1-5-7-9-11-13-15-17-33-19-23-35(24-20-33)37-28-39-40-29-38(36-25-21-34(22-26-36)18-16-14-12-10-8-6-2)44(52-46(47,48)49)30-42(40)45(43(31-50)51-4)41(39)27-32(37)3;1-18-9-25-23(12-21(18)19-5-8-28-30(10-19)51-37(47-4)36(46-3)50-28)24-13-22(20-6-7-27-29(11-20)49-32(16-43)31(15-42)48-27)34(52-38(39,40)41)14-26(24)35(25)33(17-44)45-2;1-22-17-31-29(18-27(22)23-9-13-25(14-10-23)43(3,4)5)30-19-28(24-11-15-26(16-12-24)44(6,7)8)34(42-36(37,38)39)20-32(30)35(31)33(21-40)41-2;1-8-3-12-10(4-9(8)18-20(29)24(33)42-25(34)21(18)30)11-5-14(19-22(31)26(35)43-27(36)23(19)32)16(44-28(37,38)39)6-13(11)17(12)15(7-40)41-2;1-16-11-23-21(12-19(16)17-3-7-34-8-4-17)22-13-20(18-5-9-35-10-6-18)26(36-28(29,30)31)14-24(22)27(23)25(15-32)33-2;1-16-11-20-18(12-17(16)23-7-3-5-9-34-23)19-13-22(24-8-4-6-10-35-24)26(36-28(29,30)31)14-21(19)27(20)25(15-32)33-2/h19-30H,5-18H2,1-3H3;5-14H,1H3;9-20H,1,3-8H3;3-6H,1H3;3-14H,1H3;3-14,25,27H,1H3/b45-43+;2*35-33+;17-15+;27-25+;
InChIKeyRFISEWQEUKLSLP-VVNNZXMASA-N
XLogP55.31
TPSA409.48 Ų
H-Bond Donors
H-Bond Acceptors24
Rotatable Bonds35
Heavy Atoms264
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003595.61
LogP ≤ 555.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1024

Analyze 6-[(9E)-9-[cyano(isocyano)methylidene]-6-(2,3-diisocyanoquinoxalin-6-yl)-7-methyl-2-(trifluoromethoxy)fluoren-3-yl]quinoxaline-2,3-dicarbonitrile;(2E)-2-isocyano-2-[2-methyl-3,6-bis(4-octylphenyl)-7-(trifluoromethoxy)fluoren-9-ylidene]acetonitrile;(2E)-2-isocyano-2-[2-methyl-3,6-bis(2,3,5,6-tetrafluoro-4-pyridinyl)-7-(trifluoromethoxy)fluoren-9-ylidene]acetonitrile;2-isocyano-2-[2-methyl-3,6-dipyridin-2-yl-7-(trifluoromethoxy)-9H-fluoren-9-yl]acetonitrile;(2E)-2-isocyano-2-[2-methyl-3,6-dipyridin-4-yl-7-(trifluoromethoxy)fluoren-9-ylidene]acetonitrile;(2E)-2-isocyano-2-[2-methyl-7-(trifluoromethoxy)-3,6-bis(4-trimethylsilylphenyl)fluoren-9-ylidene]acetonitrile with MolForge

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Frequently Asked Questions

What is the IUPAC name of 6-[(9E)-9-[cyano(isocyano)methylidene]-6-(2,3-diisocyanoquinoxalin-6-yl)-7-methyl-2-(trifluoromethoxy)fluoren-3-yl]quinoxaline-2,3-dicarbonitrile;(2E)-2-isocyano-2-[2-methyl-3,6-bis(4-octylphenyl)-7-(trifluoromethoxy)fluoren-9-ylidene]acetonitrile;(2E)-2-isocyano-2-[2-methyl-3,6-bis(2,3,5,6-tetrafluoro-4-pyridinyl)-7-(trifluoromethoxy)fluoren-9-ylidene]acetonitrile;2-isocyano-2-[2-methyl-3,6-dipyridin-2-yl-7-(trifluoromethoxy)-9H-fluoren-9-yl]acetonitrile;(2E)-2-isocyano-2-[2-methyl-3,6-dipyridin-4-yl-7-(trifluoromethoxy)fluoren-9-ylidene]acetonitrile;(2E)-2-isocyano-2-[2-methyl-7-(trifluoromethoxy)-3,6-bis(4-trimethylsilylphenyl)fluoren-9-ylidene]acetonitrile?
The IUPAC name of 6-[(9E)-9-[cyano(isocyano)methylidene]-6-(2,3-diisocyanoquinoxalin-6-yl)-7-methyl-2-(trifluoromethoxy)fluoren-3-yl]quinoxaline-2,3-dicarbonitrile;(2E)-2-isocyano-2-[2-methyl-3,6-bis(4-octylphenyl)-7-(trifluoromethoxy)fluoren-9-ylidene]acetonitrile;(2E)-2-isocyano-2-[2-methyl-3,6-bis(2,3,5,6-tetrafluoro-4-pyridinyl)-7-(trifluoromethoxy)fluoren-9-ylidene]acetonitrile;2-isocyano-2-[2-methyl-3,6-dipyridin-2-yl-7-(trifluoromethoxy)-9H-fluoren-9-yl]acetonitrile;(2E)-2-isocyano-2-[2-methyl-3,6-dipyridin-4-yl-7-(trifluoromethoxy)fluoren-9-ylidene]acetonitrile;(2E)-2-isocyano-2-[2-methyl-7-(trifluoromethoxy)-3,6-bis(4-trimethylsilylphenyl)fluoren-9-ylidene]acetonitrile (CID 160609681) is 6-[(9E)-9-[cyano(isocyano)methylidene]-6-(2,3-diisocyanoquinoxalin-6-yl)-7-methyl-2-(trifluoromethoxy)fluoren-3-yl]quinoxaline-2,3-dicarbonitrile;(2E)-2-isocyano-2-[2-methyl-3,6-bis(4-octylphenyl)-7-(trifluoromethoxy)fluoren-9-ylidene]acetonitrile;(2E)-2-isocyano-2-[2-methyl-3,6-bis(2,3,5,6-tetrafluoro-4-pyridinyl)-7-(trifluoromethoxy)fluoren-9-ylidene]acetonitrile;2-isocyano-2-[2-methyl-3,6-dipyridin-2-yl-7-(trifluoromethoxy)-9H-fluoren-9-yl]acetonitrile;(2E)-2-isocyano-2-[2-methyl-3,6-dipyridin-4-yl-7-(trifluoromethoxy)fluoren-9-ylidene]acetonitrile;(2E)-2-isocyano-2-[2-methyl-7-(trifluoromethoxy)-3,6-bis(4-trimethylsilylphenyl)fluoren-9-ylidene]acetonitrile.
What is the SMILES notation for 6-[(9E)-9-[cyano(isocyano)methylidene]-6-(2,3-diisocyanoquinoxalin-6-yl)-7-methyl-2-(trifluoromethoxy)fluoren-3-yl]quinoxaline-2,3-dicarbonitrile;(2E)-2-isocyano-2-[2-methyl-3,6-bis(4-octylphenyl)-7-(trifluoromethoxy)fluoren-9-ylidene]acetonitrile;(2E)-2-isocyano-2-[2-methyl-3,6-bis(2,3,5,6-tetrafluoro-4-pyridinyl)-7-(trifluoromethoxy)fluoren-9-ylidene]acetonitrile;2-isocyano-2-[2-methyl-3,6-dipyridin-2-yl-7-(trifluoromethoxy)-9H-fluoren-9-yl]acetonitrile;(2E)-2-isocyano-2-[2-methyl-3,6-dipyridin-4-yl-7-(trifluoromethoxy)fluoren-9-ylidene]acetonitrile;(2E)-2-isocyano-2-[2-methyl-7-(trifluoromethoxy)-3,6-bis(4-trimethylsilylphenyl)fluoren-9-ylidene]acetonitrile?
The canonical SMILES for 6-[(9E)-9-[cyano(isocyano)methylidene]-6-(2,3-diisocyanoquinoxalin-6-yl)-7-methyl-2-(trifluoromethoxy)fluoren-3-yl]quinoxaline-2,3-dicarbonitrile;(2E)-2-isocyano-2-[2-methyl-3,6-bis(4-octylphenyl)-7-(trifluoromethoxy)fluoren-9-ylidene]acetonitrile;(2E)-2-isocyano-2-[2-methyl-3,6-bis(2,3,5,6-tetrafluoro-4-pyridinyl)-7-(trifluoromethoxy)fluoren-9-ylidene]acetonitrile;2-isocyano-2-[2-methyl-3,6-dipyridin-2-yl-7-(trifluoromethoxy)-9H-fluoren-9-yl]acetonitrile;(2E)-2-isocyano-2-[2-methyl-3,6-dipyridin-4-yl-7-(trifluoromethoxy)fluoren-9-ylidene]acetonitrile;(2E)-2-isocyano-2-[2-methyl-7-(trifluoromethoxy)-3,6-bis(4-trimethylsilylphenyl)fluoren-9-ylidene]acetonitrile is [C-]#[N+]/C(C#N)=C1\c2cc(C)c(-c3c(F)c(F)nc(F)c3F)cc2-c2cc(-c3c(F)c(F)nc(F)c3F)c(OC(F)(F)F)cc21.[C-]#[N+]/C(C#N)=C1\c2cc(C)c(-c3ccc(CCCCCCCC)cc3)cc2-c2cc(-c3ccc(CCCCCCCC)cc3)c(OC(F)(F)F)cc21.[C-]#[N+]/C(C#N)=C1\c2cc(C)c(-c3ccc([Si](C)(C)C)cc3)cc2-c2cc(-c3ccc([Si](C)(C)C)cc3)c(OC(F)(F)F)cc21.[C-]#[N+]/C(C#N)=C1\c2cc(C)c(-c3ccc4nc([N+]#[C-])c([N+]#[C-])nc4c3)cc2-c2cc(-c3ccc4nc(C#N)c(C#N)nc4c3)c(OC(F)(F)F)cc21.[C-]#[N+]/C(C#N)=C1\c2cc(C)c(-c3ccncc3)cc2-c2cc(-c3ccncc3)c(OC(F)(F)F)cc21.[C-]#[N+]C(C#N)C1c2cc(C)c(-c3ccccn3)cc2-c2cc(-c3ccccn3)c(OC(F)(F)F)cc21.
What is the InChIKey of 6-[(9E)-9-[cyano(isocyano)methylidene]-6-(2,3-diisocyanoquinoxalin-6-yl)-7-methyl-2-(trifluoromethoxy)fluoren-3-yl]quinoxaline-2,3-dicarbonitrile;(2E)-2-isocyano-2-[2-methyl-3,6-bis(4-octylphenyl)-7-(trifluoromethoxy)fluoren-9-ylidene]acetonitrile;(2E)-2-isocyano-2-[2-methyl-3,6-bis(2,3,5,6-tetrafluoro-4-pyridinyl)-7-(trifluoromethoxy)fluoren-9-ylidene]acetonitrile;2-isocyano-2-[2-methyl-3,6-dipyridin-2-yl-7-(trifluoromethoxy)-9H-fluoren-9-yl]acetonitrile;(2E)-2-isocyano-2-[2-methyl-3,6-dipyridin-4-yl-7-(trifluoromethoxy)fluoren-9-ylidene]acetonitrile;(2E)-2-isocyano-2-[2-methyl-7-(trifluoromethoxy)-3,6-bis(4-trimethylsilylphenyl)fluoren-9-ylidene]acetonitrile?
The InChIKey is RFISEWQEUKLSLP-VVNNZXMASA-N. The full InChI is InChI=1S/C46H49F3N2O.C38H13F3N10O.C36H33F3N2OSi2.C28H7F11N4O.C28H15F3N4O.C28H17F3N4O/c1-5-7-9-11-13-15-17-33-19-23-35(24-20-33)37-28-39-40-29-38(36-25-21-34(22-26-36)18-16-14-12-10-8-6-2)44(52-46(47,48)49)30-42(40)45(43(31-50)51-4)41(39)27-32(37)3;1-18-9-25-23(12-21(18)19-5-8-28-30(10-19)51-37(47-4)36(46-3)50-28)24-13-22(20-6-7-27-29(11-20)49-32(16-43)31(15-42)48-27)34(52-38(39,40)41)14-26(24)35(25)33(17-44)45-2;1-22-17-31-29(18-27(22)23-9-13-25(14-10-23)43(3,4)5)30-19-28(24-11-15-26(16-12-24)44(6,7)8)34(42-36(37,38)39)20-32(30)35(31)33(21-40)41-2;1-8-3-12-10(4-9(8)18-20(29)24(33)42-25(34)21(18)30)11-5-14(19-22(31)26(35)43-27(36)23(19)32)16(44-28(37,38)39)6-13(11)17(12)15(7-40)41-2;1-16-11-23-21(12-19(16)17-3-7-34-8-4-17)22-13-20(18-5-9-35-10-6-18)26(36-28(29,30)31)14-24(22)27(23)25(15-32)33-2;1-16-11-20-18(12-17(16)23-7-3-5-9-34-23)19-13-22(24-8-4-6-10-35-24)26(36-28(29,30)31)14-21(19)27(20)25(15-32)33-2/h19-30H,5-18H2,1-3H3;5-14H,1H3;9-20H,1,3-8H3;3-6H,1H3;3-14H,1H3;3-14,25,27H,1H3/b45-43+;2*35-33+;17-15+;27-25+;.
What are the key properties of 6-[(9E)-9-[cyano(isocyano)methylidene]-6-(2,3-diisocyanoquinoxalin-6-yl)-7-methyl-2-(trifluoromethoxy)fluoren-3-yl]quinoxaline-2,3-dicarbonitrile;(2E)-2-isocyano-2-[2-methyl-3,6-bis(4-octylphenyl)-7-(trifluoromethoxy)fluoren-9-ylidene]acetonitrile;(2E)-2-isocyano-2-[2-methyl-3,6-bis(2,3,5,6-tetrafluoro-4-pyridinyl)-7-(trifluoromethoxy)fluoren-9-ylidene]acetonitrile;2-isocyano-2-[2-methyl-3,6-dipyridin-2-yl-7-(trifluoromethoxy)-9H-fluoren-9-yl]acetonitrile;(2E)-2-isocyano-2-[2-methyl-3,6-dipyridin-4-yl-7-(trifluoromethoxy)fluoren-9-ylidene]acetonitrile;(2E)-2-isocyano-2-[2-methyl-7-(trifluoromethoxy)-3,6-bis(4-trimethylsilylphenyl)fluoren-9-ylidene]acetonitrile?
6-[(9E)-9-[cyano(isocyano)methylidene]-6-(2,3-diisocyanoquinoxalin-6-yl)-7-methyl-2-(trifluoromethoxy)fluoren-3-yl]quinoxaline-2,3-dicarbonitrile;(2E)-2-isocyano-2-[2-methyl-3,6-bis(4-octylphenyl)-7-(trifluoromethoxy)fluoren-9-ylidene]acetonitrile;(2E)-2-isocyano-2-[2-methyl-3,6-bis(2,3,5,6-tetrafluoro-4-pyridinyl)-7-(trifluoromethoxy)fluoren-9-ylidene]acetonitrile;2-isocyano-2-[2-methyl-3,6-dipyridin-2-yl-7-(trifluoromethoxy)-9H-fluoren-9-yl]acetonitrile;(2E)-2-isocyano-2-[2-methyl-3,6-dipyridin-4-yl-7-(trifluoromethoxy)fluoren-9-ylidene]acetonitrile;(2E)-2-isocyano-2-[2-methyl-7-(trifluoromethoxy)-3,6-bis(4-trimethylsilylphenyl)fluoren-9-ylidene]acetonitrile has a molecular weight of 3595.61 g/mol, XLogP of 55.31, 35 rotatable bonds, 0 hydrogen bond donors, and 24 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(9E)-9-[cyano(isocyano)methylidene]-6-(2,3-diisocyanoquinoxalin-6-yl)-7-methyl-2-(trifluoromethoxy)fluoren-3-yl]quinoxaline-2,3-dicarbonitrile;(2E)-2-isocyano-2-[2-methyl-3,6-bis(4-octylphenyl)-7-(trifluoromethoxy)fluoren-9-ylidene]acetonitrile;(2E)-2-isocyano-2-[2-methyl-3,6-bis(2,3,5,6-tetrafluoro-4-pyridinyl)-7-(trifluoromethoxy)fluoren-9-ylidene]acetonitrile;2-isocyano-2-[2-methyl-3,6-dipyridin-2-yl-7-(trifluoromethoxy)-9H-fluoren-9-yl]acetonitrile;(2E)-2-isocyano-2-[2-methyl-3,6-dipyridin-4-yl-7-(trifluoromethoxy)fluoren-9-ylidene]acetonitrile;(2E)-2-isocyano-2-[2-methyl-7-(trifluoromethoxy)-3,6-bis(4-trimethylsilylphenyl)fluoren-9-ylidene]acetonitrile is sourced from PubChem (CID 160609681), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).