1-[6-(4-tert-butylbenzene-6-id-1-yl)-3-pyridinyl]-2-methylpropan-1-one;(4-tert-butylphenyl)-(6-phenyl-3-pyridinyl)methanone;tris(2-(9,9-dimethyl-3H-fluoren-3-id-2-yl)quinoline);2,2-dimethyl-1-[6-(4-methylbenzene-6-id-1-yl)-3-pyridinyl]propan-1-one;(9,9-dimethyl-7-quinolin-2-yl-6H-fluoren-6-id-2-yl)-triphenylsilane;2-(9,9-dioctyl-3H-fluoren-3-id-2-yl)quinoline;2-(7-ethyl-9,9-dimethyl-3H-fluoren-3-id-2-yl)quinoline;hexakis(iridium);phenyl-(6-phenyl-3-pyridinyl)methanone;1-(6-phenyl-3-pyridinyl)ethanone;phenyl-[6-(4-trimethylsilylbenzene-6-id-1-yl)-3-pyridinyl]methanone

C288H256Ir6N12O6Si2-12 — CID 157426080

IUPAC1-[6-(4-tert-butylbenzene-6-id-1-yl)-3-pyridinyl]-2-methylpropan-1-one;(4-tert-butylphenyl)-(6-phenyl-3-pyridinyl)methanone;tris(2-(9,9-dimethyl-3H-fluoren-3-id-2-yl)quinoline);2,2-dimethyl-1-[6-(4-methylbenzene-6-id-1-yl)-3-pyridinyl]propan-1-one;(9,9-dimethyl-7-quinolin-2-yl-6H-fluoren-6-id-2-yl)-triphenylsilane;2-(9,9-dioctyl-3H-fluoren-3-id-2-yl)quinoline;2-(7-ethyl-9,9-dimethyl-3H-fluoren-3-id-2-yl)quinoline;hexakis(iridium);phenyl-(6-phenyl-3-pyridinyl)methanone;1-(6-phenyl-3-pyridinyl)ethanone;phenyl-[6-(4-trimethylsilylbenzene-6-id-1-yl)-3-pyridinyl]methanone
SMILESCC(=O)c1ccc(-c2[c-]cccc2)nc1.CC(C)(C)c1ccc(C(=O)c2ccc(-c3[c-]cccc3)nc2)cc1.CC(C)C(=O)c1ccc(-c2[c-]cc(C(C)(C)C)cc2)nc1.CC1(C)c2cc(-c3ccc4ccccc4n3)[c-]cc2-c2ccc([Si](c3ccccc3)(c3ccccc3)c3ccccc3)cc21.CC1(C)c2ccccc2-c2c[c-]c(-c3ccc4ccccc4n3)cc21.CC1(C)c2ccccc2-c2c[c-]c(-c3ccc4ccccc4n3)cc21.CC1(C)c2ccccc2-c2c[c-]c(-c3ccc4ccccc4n3)cc21.CCCCCCCCC1(CCCCCCCC)c2ccccc2-c2c[c-]c(-c3ccc4ccccc4n3)cc21.CCc1ccc2c(c1)C(C)(C)c1cc(-c3ccc4ccccc4n3)[c-]cc1-2.C[Si](C)(C)c1c[c-]c(-c2ccc(C(=O)c3ccccc3)cn2)cc1.Cc1c[c-]c(-c2ccc(C(=O)C(C)(C)C)cn2)cc1.O=C(c1ccccc1)c1ccc(-c2[c-]cccc2)nc1.[Ir].[Ir].[Ir].[Ir].[Ir].[Ir]
InChIInChI=1S/C42H32NSi.C38H46N.C26H22N.3C24H18N.C22H20NO.C21H20NOSi.C19H22NO.C18H12NO.C17H18NO.C13H10NO.6Ir/c1-42(2)38-28-31(41-27-23-30-14-12-13-21-40(30)43-41)22-25-36(38)37-26-24-35(29-39(37)42)44(32-15-6-3-7-16-32,33-17-8-4-9-18-33)34-19-10-5-11-20-34;1-3-5-7-9-11-17-27-38(28-18-12-10-8-6-4-2)34-21-15-14-20-32(34)33-25-23-31(29-35(33)38)37-26-24-30-19-13-16-22-36(30)39-37;1-4-17-9-12-20-21-13-10-19(16-23(21)26(2,3)22(20)15-17)25-14-11-18-7-5-6-8-24(18)27-25;3*1-24(2)20-9-5-4-8-18(20)19-13-11-17(15-21(19)24)23-14-12-16-7-3-6-10-22(16)25-23;1-22(2,3)19-12-9-17(10-13-19)21(24)18-11-14-20(23-15-18)16-7-5-4-6-8-16;1-24(2,3)19-12-9-16(10-13-19)20-14-11-18(15-22-20)21(23)17-7-5-4-6-8-17;1-13(2)18(21)15-8-11-17(20-12-15)14-6-9-16(10-7-14)19(3,4)5;20-18(15-9-5-2-6-10-15)16-11-12-17(19-13-16)14-7-3-1-4-8-14;1-12-5-7-13(8-6-12)15-10-9-14(11-18-15)16(19)17(2,3)4;1-10(15)12-7-8-13(14-9-12)11-5-3-2-4-6-11;;;;;;/h3-21,23-29H,1-2H3;13-16,19-22,24-26,29H,3-12,17-18,27-28H2,1-2H3;5-9,11-16H,4H2,1-3H3;3*3-10,12-15H,1-2H3;4-7,9-15H,1-3H3;4-9,11-15H,1-3H3;6,8-13H,1-5H3;1-7,9-13H;5-7,9-11H,1-4H3;2-5,7-9H,1H3;;;;;;/q12*-1;;;;;;
InChIKeyGFIPWXAEMTXMAF-UHFFFAOYSA-N
MW5190.77 g/mol
LogP68.14
Rot. Bonds42

About 1-[6-(4-tert-butylbenzene-6-id-1-yl)-3-pyridinyl]-2-methylpropan-1-one;(4-tert-butylphenyl)-(6-phenyl-3-pyridinyl)methanone;tris(2-(9,9-dimethyl-3H-fluoren-3-id-2-yl)quinoline);2,2-dimethyl-1-[6-(4-methylbenzene-6-id-1-yl)-3-pyridinyl]propan-1-one;(9,9-dimethyl-7-quinolin-2-yl-6H-fluoren-6-id-2-yl)-triphenylsilane;2-(9,9-dioctyl-3H-fluoren-3-id-2-yl)quinoline;2-(7-ethyl-9,9-dimethyl-3H-fluoren-3-id-2-yl)quinoline;hexakis(iridium);phenyl-(6-phenyl-3-pyridinyl)methanone;1-(6-phenyl-3-pyridinyl)ethanone;phenyl-[6-(4-trimethylsilylbenzene-6-id-1-yl)-3-pyridinyl]methanone

1-[6-(4-tert-butylbenzene-6-id-1-yl)-3-pyridinyl]-2-methylpropan-1-one;(4-tert-butylphenyl)-(6-phenyl-3-pyridinyl)methanone;tris(2-(9,9-dimethyl-3H-fluoren-3-id-2-yl)quinoline);2,2-dimethyl-1-[6-(4-methylbenzene-6-id-1-yl)-3-pyridinyl]propan-1-one;(9,9-dimethyl-7-quinolin-2-yl-6H-fluoren-6-id-2-yl)-triphenylsilane;2-(9,9-dioctyl-3H-fluoren-3-id-2-yl)quinoline;2-(7-ethyl-9,9-dimethyl-3H-fluoren-3-id-2-yl)quinoline;hexakis(iridium);phenyl-(6-phenyl-3-pyridinyl)methanone;1-(6-phenyl-3-pyridinyl)ethanone;phenyl-[6-(4-trimethylsilylbenzene-6-id-1-yl)-3-pyridinyl]methanone (PubChem CID 157426080) has the molecular formula C288H256Ir6N12O6Si2-12 and a molecular weight of 5190.77 g/mol. Its IUPAC name is 1-[6-(4-tert-butylbenzene-6-id-1-yl)-3-pyridinyl]-2-methylpropan-1-one;(4-tert-butylphenyl)-(6-phenyl-3-pyridinyl)methanone;tris(2-(9,9-dimethyl-3H-fluoren-3-id-2-yl)quinoline);2,2-dimethyl-1-[6-(4-methylbenzene-6-id-1-yl)-3-pyridinyl]propan-1-one;(9,9-dimethyl-7-quinolin-2-yl-6H-fluoren-6-id-2-yl)-triphenylsilane;2-(9,9-dioctyl-3H-fluoren-3-id-2-yl)quinoline;2-(7-ethyl-9,9-dimethyl-3H-fluoren-3-id-2-yl)quinoline;hexakis(iridium);phenyl-(6-phenyl-3-pyridinyl)methanone;1-(6-phenyl-3-pyridinyl)ethanone;phenyl-[6-(4-trimethylsilylbenzene-6-id-1-yl)-3-pyridinyl]methanone.

Molecular Properties

Compound Name1-[6-(4-tert-butylbenzene-6-id-1-yl)-3-pyridinyl]-2-methylpropan-1-one;(4-tert-butylphenyl)-(6-phenyl-3-pyridinyl)methanone;tris(2-(9,9-dimethyl-3H-fluoren-3-id-2-yl)quinoline);2,2-dimethyl-1-[6-(4-methylbenzene-6-id-1-yl)-3-pyridinyl]propan-1-one;(9,9-dimethyl-7-quinolin-2-yl-6H-fluoren-6-id-2-yl)-triphenylsilane;2-(9,9-dioctyl-3H-fluoren-3-id-2-yl)quinoline;2-(7-ethyl-9,9-dimethyl-3H-fluoren-3-id-2-yl)quinoline;hexakis(iridium);phenyl-(6-phenyl-3-pyridinyl)methanone;1-(6-phenyl-3-pyridinyl)ethanone;phenyl-[6-(4-trimethylsilylbenzene-6-id-1-yl)-3-pyridinyl]methanone
PubChem CID157426080
Molecular FormulaC288H256Ir6N12O6Si2-12
Molecular Weight5190.77 g/mol
Exact Mass5191.75
IUPAC Name1-[6-(4-tert-butylbenzene-6-id-1-yl)-3-pyridinyl]-2-methylpropan-1-one;(4-tert-butylphenyl)-(6-phenyl-3-pyridinyl)methanone;tris(2-(9,9-dimethyl-3H-fluoren-3-id-2-yl)quinoline);2,2-dimethyl-1-[6-(4-methylbenzene-6-id-1-yl)-3-pyridinyl]propan-1-one;(9,9-dimethyl-7-quinolin-2-yl-6H-fluoren-6-id-2-yl)-triphenylsilane;2-(9,9-dioctyl-3H-fluoren-3-id-2-yl)quinoline;2-(7-ethyl-9,9-dimethyl-3H-fluoren-3-id-2-yl)quinoline;hexakis(iridium);phenyl-(6-phenyl-3-pyridinyl)methanone;1-(6-phenyl-3-pyridinyl)ethanone;phenyl-[6-(4-trimethylsilylbenzene-6-id-1-yl)-3-pyridinyl]methanone
SMILESCC(=O)c1ccc(-c2[c-]cccc2)nc1.CC(C)(C)c1ccc(C(=O)c2ccc(-c3[c-]cccc3)nc2)cc1.CC(C)C(=O)c1ccc(-c2[c-]cc(C(C)(C)C)cc2)nc1.CC1(C)c2cc(-c3ccc4ccccc4n3)[c-]cc2-c2ccc([Si](c3ccccc3)(c3ccccc3)c3ccccc3)cc21.CC1(C)c2ccccc2-c2c[c-]c(-c3ccc4ccccc4n3)cc21.CC1(C)c2ccccc2-c2c[c-]c(-c3ccc4ccccc4n3)cc21.CC1(C)c2ccccc2-c2c[c-]c(-c3ccc4ccccc4n3)cc21.CCCCCCCCC1(CCCCCCCC)c2ccccc2-c2c[c-]c(-c3ccc4ccccc4n3)cc21.CCc1ccc2c(c1)C(C)(C)c1cc(-c3ccc4ccccc4n3)[c-]cc1-2.C[Si](C)(C)c1c[c-]c(-c2ccc(C(=O)c3ccccc3)cn2)cc1.Cc1c[c-]c(-c2ccc(C(=O)C(C)(C)C)cn2)cc1.O=C(c1ccccc1)c1ccc(-c2[c-]cccc2)nc1.[Ir].[Ir].[Ir].[Ir].[Ir].[Ir]
InChIInChI=1S/C42H32NSi.C38H46N.C26H22N.3C24H18N.C22H20NO.C21H20NOSi.C19H22NO.C18H12NO.C17H18NO.C13H10NO.6Ir/c1-42(2)38-28-31(41-27-23-30-14-12-13-21-40(30)43-41)22-25-36(38)37-26-24-35(29-39(37)42)44(32-15-6-3-7-16-32,33-17-8-4-9-18-33)34-19-10-5-11-20-34;1-3-5-7-9-11-17-27-38(28-18-12-10-8-6-4-2)34-21-15-14-20-32(34)33-25-23-31(29-35(33)38)37-26-24-30-19-13-16-22-36(30)39-37;1-4-17-9-12-20-21-13-10-19(16-23(21)26(2,3)22(20)15-17)25-14-11-18-7-5-6-8-24(18)27-25;3*1-24(2)20-9-5-4-8-18(20)19-13-11-17(15-21(19)24)23-14-12-16-7-3-6-10-22(16)25-23;1-22(2,3)19-12-9-17(10-13-19)21(24)18-11-14-20(23-15-18)16-7-5-4-6-8-16;1-24(2,3)19-12-9-16(10-13-19)20-14-11-18(15-22-20)21(23)17-7-5-4-6-8-17;1-13(2)18(21)15-8-11-17(20-12-15)14-6-9-16(10-7-14)19(3,4)5;20-18(15-9-5-2-6-10-15)16-11-12-17(19-13-16)14-7-3-1-4-8-14;1-12-5-7-13(8-6-12)15-10-9-14(11-18-15)16(19)17(2,3)4;1-10(15)12-7-8-13(14-9-12)11-5-3-2-4-6-11;;;;;;/h3-21,23-29H,1-2H3;13-16,19-22,24-26,29H,3-12,17-18,27-28H2,1-2H3;5-9,11-16H,4H2,1-3H3;3*3-10,12-15H,1-2H3;4-7,9-15H,1-3H3;4-9,11-15H,1-3H3;6,8-13H,1-5H3;1-7,9-13H;5-7,9-11H,1-4H3;2-5,7-9H,1H3;;;;;;/q12*-1;;;;;;
InChIKeyGFIPWXAEMTXMAF-UHFFFAOYSA-N
XLogP68.14
TPSA257.10 Ų
H-Bond Donors
H-Bond Acceptors18
Rotatable Bonds42
Heavy Atoms314
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5005190.77
LogP ≤ 568.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1018

Analyze 1-[6-(4-tert-butylbenzene-6-id-1-yl)-3-pyridinyl]-2-methylpropan-1-one;(4-tert-butylphenyl)-(6-phenyl-3-pyridinyl)methanone;tris(2-(9,9-dimethyl-3H-fluoren-3-id-2-yl)quinoline);2,2-dimethyl-1-[6-(4-methylbenzene-6-id-1-yl)-3-pyridinyl]propan-1-one;(9,9-dimethyl-7-quinolin-2-yl-6H-fluoren-6-id-2-yl)-triphenylsilane;2-(9,9-dioctyl-3H-fluoren-3-id-2-yl)quinoline;2-(7-ethyl-9,9-dimethyl-3H-fluoren-3-id-2-yl)quinoline;hexakis(iridium);phenyl-(6-phenyl-3-pyridinyl)methanone;1-(6-phenyl-3-pyridinyl)ethanone;phenyl-[6-(4-trimethylsilylbenzene-6-id-1-yl)-3-pyridinyl]methanone with MolForge

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Related Compounds

Tris(3,7-diethyl-9,9,9-trifluoro-6-hydroxynon-5-en-4-one);1-(3,5-dimethylbenzene-6-id-1-yl)isoquinoline;tris([1-(3,5-dimethylbenzene-6-id-1-yl)isoquinolin-6-yl]-trimethylsilane);1-(3,5-dimethylbenzene-6-id-1-yl)-6-methylisoquinoline;1-(3,5-dimethylbenzene-6-id-1-yl)-6-propan-2-ylisoquinoline;tris(iridium)
CID 157214989
[1-(3-Tert-butyl-5-methylbenzene-6-id-1-yl)isoquinolin-6-yl]-trimethylsilane;bis([3-deuterio-1-(3,5-dimethylbenzene-6-id-1-yl)isoquinolin-6-yl]-trimethylsilane);bis(3,7-diethyl-6-hydroxynon-5-en-4-one);bis(3,7-diethyl-9,9,9-trifluoro-6-hydroxynon-5-en-4-one);1-(3,5-dimethylbenzene-6-id-1-yl)isoquinoline;bis([1-(3,5-dimethylbenzene-6-id-1-yl)isoquinolin-6-yl]-trimethylsilane);1-(3,5-dimethylbenzene-6-id-1-yl)-6-methylisoquinoline;ethane;tetrakis(iridium);trimethyl-[1-(3-methyl-5-propan-2-ylbenzene-2-id-1-yl)isoquinolin-6-yl]silane
CID 157244891
(4R)-4-(4-fluorophenyl)-8-[(2R)-2-methyl-4-oxo-4-quinolin-3-ylbutyl]-2,8-diazaspiro[4.5]decan-1-one;(4S)-4-(4-fluorophenyl)-8-[(2R)-2-methyl-4-oxo-4-quinolin-3-ylbutyl]-2,8-diazaspiro[4.5]decan-1-one;bis(4-(4-fluorophenyl)-8-(4-naphthalen-2-yl-4-oxobutyl)-2,8-diazaspiro[4.5]decan-1-one);4-(4-fluorophenyl)-8-(4-oxo-4-quinolin-3-ylbutyl)-2,8-diazaspiro[4.5]decan-1-one;methane;hexakis(2,2,2-trifluoroacetic acid)
CID 157674471
4-(4-fluorophenyl)-8-[(2R)-2-methyl-4-naphthalen-2-yl-4-oxobutyl]-2,8-diazaspiro[4.5]decan-1-one;(4R)-4-(4-fluorophenyl)-8-[(2R)-2-methyl-4-oxo-4-quinolin-3-ylbutyl]-2,8-diazaspiro[4.5]decan-1-one;(4S)-4-(4-fluorophenyl)-8-[(2R)-2-methyl-4-oxo-4-quinolin-3-ylbutyl]-2,8-diazaspiro[4.5]decan-1-one;bis(4-(4-fluorophenyl)-8-(4-naphthalen-2-yl-4-oxobutyl)-2,8-diazaspiro[4.5]decan-1-one);pentakis(2,2,2-trifluoroacetic acid)
CID 157859796
[1-(3-Tert-butyl-5-methylbenzene-6-id-1-yl)isoquinolin-6-yl]-trimethylsilane;bis([3-deuterio-1-(3,5-dimethylbenzene-6-id-1-yl)isoquinolin-6-yl]-trimethylsilane);3,7-diethyl-6-hydroxy-7-methylnon-5-en-4-one;tris(3,7-diethyl-9,9,9-trifluoro-6-hydroxynon-5-en-4-one);[1-(3,5-dimethylbenzene-6-id-1-yl)isoquinolin-6-yl]-dimethyl-phenylsilane;[1-(3,5-dimethylbenzene-6-id-1-yl)isoquinolin-6-yl]-dimethyl-propan-2-ylsilane;tris([1-(3,5-dimethylbenzene-6-id-1-yl)isoquinolin-6-yl]-trimethylsilane);tetrakis(iridium)
CID 157917034
Bis(6-cyclohexyl-3,4-dideuterio-1-(3,5-dimethylbenzene-6-id-1-yl)isoquinoline);bis(6-(cyclopentylmethyl)-3,4-dideuterio-1-(3,5-dimethylbenzene-6-id-1-yl)isoquinoline);bis([3,4-dideuterio-1-(3,5-dimethylbenzene-6-id-1-yl)isoquinolin-6-yl]-trimethylsilane);3,4-dideuterio-1-[3-methyl-5-(trideuteriomethyl)benzene-2-id-1-yl]-6-propan-2-ylisoquinoline;3,4-dideuterio-1-[3-methyl-5-(trideuteriomethyl)benzene-6-id-1-yl]-6-propan-2-ylisoquinoline;tetrakis(3,7-diethyl-9,9-difluoro-6-hydroxydec-5-en-4-one);tetrakis(iridium)
CID 158005497
Bis(6-cyclohexyl-3-deuterio-1-(3,5-dimethylbenzene-6-id-1-yl)isoquinoline);bis(6-cyclopentyl-3-deuterio-1-(3,5-dimethylbenzene-6-id-1-yl)isoquinoline);6-cyclopentyl-3-deuterio-1-[3-methyl-5-(trideuteriomethyl)benzene-2-id-1-yl]isoquinoline;6-cyclopentyl-3-deuterio-1-[3-methyl-5-(trideuteriomethyl)benzene-6-id-1-yl]isoquinoline;bis([3-deuterio-1-(3,5-dimethylbenzene-6-id-1-yl)isoquinolin-6-yl]-trimethylsilane);3-deuterio-1-[3-methyl-5-(trideuteriomethyl)benzene-2-id-1-yl]-6-propan-2-ylisoquinoline;3-deuterio-1-[3-methyl-5-(trideuteriomethyl)benzene-6-id-1-yl]-6-propan-2-ylisoquinoline;pentakis(3,7-diethyl-9,9,9-trifluoro-6-hydroxynon-5-en-4-one);pentakis(iridium)
CID 158251572
Bis([1-(3-tert-butyl-5-methylbenzene-6-id-1-yl)isoquinolin-6-yl]-trimethylsilane);[3-deuterio-1-(3,5-dimethylbenzene-6-id-1-yl)isoquinolin-6-yl]-trimethylsilane;tris(3,7-diethyl-6-hydroxynon-5-en-4-one);3,7-diethyl-9,9,9-trifluoro-6-hydroxynon-5-en-4-one;[1-(3,5-dimethylbenzene-6-id-1-yl)isoquinolin-6-yl]-dimethyl-phenylsilane;[1-(3,5-dimethylbenzene-6-id-1-yl)isoquinolin-6-yl]-dimethyl-propan-2-ylsilane;tris([1-(3,5-dimethylbenzene-6-id-1-yl)isoquinolin-6-yl]-trimethylsilane);tetrakis(iridium)
CID 158299089
6-Cyclopentyl-1-(3,5-dimethylbenzene-6-id-1-yl)isoquinoline;[3-deuterio-1-(3,5-dimethylbenzene-6-id-1-yl)isoquinolin-6-yl]-trimethylsilane;3-deuterio-1-(3,5-dimethylbenzene-6-id-1-yl)-6-propan-2-ylisoquinoline;pentakis(3,7-diethyl-9,9,9-trifluoro-6-hydroxynon-5-en-4-one);[1-(3,5-dimethylbenzene-6-id-1-yl)isoquinolin-6-yl]-dimethyl-phenylsilane;[1-(3,5-dimethylbenzene-6-id-1-yl)isoquinolin-6-yl]-dimethyl-propan-2-ylsilane;bis([1-(3,5-dimethylbenzene-6-id-1-yl)isoquinolin-6-yl]-trimethylsilane);bis(1-(3,5-dimethylbenzene-6-id-1-yl)-6-propan-2-ylisoquinoline);ethane;pentakis(iridium);2-phenylpyridine
CID 158338035
6-Cyclopentyl-1-(3,5-dimethylbenzene-6-id-1-yl)isoquinoline;tetrakis(3,7-diethyl-6-hydroxy-7-methylnon-5-en-4-one);3,7-diethyl-9,9,9-trifluoro-6-hydroxynon-5-en-4-one;1-(3,5-dimethylbenzene-6-id-1-yl)isoquinoline;[1-(3,5-dimethylbenzene-6-id-1-yl)isoquinolin-6-yl]-dimethyl-phenylsilane;tetrakis([1-(3,5-dimethylbenzene-6-id-1-yl)isoquinolin-6-yl]-trimethylsilane);1-(3,5-dimethylbenzene-6-id-1-yl)-6-propan-2-ylisoquinoline;2-(3,5-dimethylbenzene-6-id-1-yl)quinoline;pentakis(iridium);2-phenylpyridine
CID 158468429
6-Cyclopentyl-3-deuterio-1-[3-methyl-5-(trideuteriomethyl)benzene-6-id-1-yl]isoquinoline;6-cyclopentyl-1-[3-methyl-5-(trideuteriomethyl)benzene-2-id-1-yl]isoquinoline;bis(3-deuterio-1-(3,5-dimethylbenzene-6-id-1-yl)-6-propan-2-ylisoquinoline);tris(3,7-diethyl-9,9,9-trifluoro-6-hydroxynon-5-en-4-one);2-(3,5-dimethylbenzene-6-id-1-yl)quinoline;tris(iridium);2-phenylpyridine
CID 158604285
Bis(6-cyclopentyl-3-deuterio-1-(3,5-dimethylbenzene-6-id-1-yl)isoquinoline);6-cyclopentyl-3-deuterio-1-(3-methyl-5-propan-2-ylbenzene-2-id-1-yl)isoquinoline;6-cyclopentyl-3-deuterio-1-[3-methyl-5-(trideuteriomethyl)benzene-2-id-1-yl]isoquinoline;[3-deuterio-1-(3,5-dimethylbenzene-6-id-1-yl)isoquinolin-6-yl]-trimethylsilane;tris(3-deuterio-1-(3,5-dimethylbenzene-6-id-1-yl)-6-methylisoquinoline);3-deuterio-1-(3,5-dimethylbenzene-6-id-1-yl)-6-propan-2-ylisoquinoline;3-deuterio-1-[3-methyl-5-(trideuteriomethyl)benzene-6-id-1-yl]-6-propan-2-ylisoquinoline;tris(3,7-diethyl-6-hydroxy-7-methylnon-5-en-4-one);bis(3,7-diethyl-9,9,9-trifluoro-6-hydroxynon-5-en-4-one);pentakis(iridium)
CID 158676206

Frequently Asked Questions

What is the IUPAC name of 1-[6-(4-tert-butylbenzene-6-id-1-yl)-3-pyridinyl]-2-methylpropan-1-one;(4-tert-butylphenyl)-(6-phenyl-3-pyridinyl)methanone;tris(2-(9,9-dimethyl-3H-fluoren-3-id-2-yl)quinoline);2,2-dimethyl-1-[6-(4-methylbenzene-6-id-1-yl)-3-pyridinyl]propan-1-one;(9,9-dimethyl-7-quinolin-2-yl-6H-fluoren-6-id-2-yl)-triphenylsilane;2-(9,9-dioctyl-3H-fluoren-3-id-2-yl)quinoline;2-(7-ethyl-9,9-dimethyl-3H-fluoren-3-id-2-yl)quinoline;hexakis(iridium);phenyl-(6-phenyl-3-pyridinyl)methanone;1-(6-phenyl-3-pyridinyl)ethanone;phenyl-[6-(4-trimethylsilylbenzene-6-id-1-yl)-3-pyridinyl]methanone?
The IUPAC name of 1-[6-(4-tert-butylbenzene-6-id-1-yl)-3-pyridinyl]-2-methylpropan-1-one;(4-tert-butylphenyl)-(6-phenyl-3-pyridinyl)methanone;tris(2-(9,9-dimethyl-3H-fluoren-3-id-2-yl)quinoline);2,2-dimethyl-1-[6-(4-methylbenzene-6-id-1-yl)-3-pyridinyl]propan-1-one;(9,9-dimethyl-7-quinolin-2-yl-6H-fluoren-6-id-2-yl)-triphenylsilane;2-(9,9-dioctyl-3H-fluoren-3-id-2-yl)quinoline;2-(7-ethyl-9,9-dimethyl-3H-fluoren-3-id-2-yl)quinoline;hexakis(iridium);phenyl-(6-phenyl-3-pyridinyl)methanone;1-(6-phenyl-3-pyridinyl)ethanone;phenyl-[6-(4-trimethylsilylbenzene-6-id-1-yl)-3-pyridinyl]methanone (CID 157426080) is 1-[6-(4-tert-butylbenzene-6-id-1-yl)-3-pyridinyl]-2-methylpropan-1-one;(4-tert-butylphenyl)-(6-phenyl-3-pyridinyl)methanone;tris(2-(9,9-dimethyl-3H-fluoren-3-id-2-yl)quinoline);2,2-dimethyl-1-[6-(4-methylbenzene-6-id-1-yl)-3-pyridinyl]propan-1-one;(9,9-dimethyl-7-quinolin-2-yl-6H-fluoren-6-id-2-yl)-triphenylsilane;2-(9,9-dioctyl-3H-fluoren-3-id-2-yl)quinoline;2-(7-ethyl-9,9-dimethyl-3H-fluoren-3-id-2-yl)quinoline;hexakis(iridium);phenyl-(6-phenyl-3-pyridinyl)methanone;1-(6-phenyl-3-pyridinyl)ethanone;phenyl-[6-(4-trimethylsilylbenzene-6-id-1-yl)-3-pyridinyl]methanone.
What is the SMILES notation for 1-[6-(4-tert-butylbenzene-6-id-1-yl)-3-pyridinyl]-2-methylpropan-1-one;(4-tert-butylphenyl)-(6-phenyl-3-pyridinyl)methanone;tris(2-(9,9-dimethyl-3H-fluoren-3-id-2-yl)quinoline);2,2-dimethyl-1-[6-(4-methylbenzene-6-id-1-yl)-3-pyridinyl]propan-1-one;(9,9-dimethyl-7-quinolin-2-yl-6H-fluoren-6-id-2-yl)-triphenylsilane;2-(9,9-dioctyl-3H-fluoren-3-id-2-yl)quinoline;2-(7-ethyl-9,9-dimethyl-3H-fluoren-3-id-2-yl)quinoline;hexakis(iridium);phenyl-(6-phenyl-3-pyridinyl)methanone;1-(6-phenyl-3-pyridinyl)ethanone;phenyl-[6-(4-trimethylsilylbenzene-6-id-1-yl)-3-pyridinyl]methanone?
The canonical SMILES for 1-[6-(4-tert-butylbenzene-6-id-1-yl)-3-pyridinyl]-2-methylpropan-1-one;(4-tert-butylphenyl)-(6-phenyl-3-pyridinyl)methanone;tris(2-(9,9-dimethyl-3H-fluoren-3-id-2-yl)quinoline);2,2-dimethyl-1-[6-(4-methylbenzene-6-id-1-yl)-3-pyridinyl]propan-1-one;(9,9-dimethyl-7-quinolin-2-yl-6H-fluoren-6-id-2-yl)-triphenylsilane;2-(9,9-dioctyl-3H-fluoren-3-id-2-yl)quinoline;2-(7-ethyl-9,9-dimethyl-3H-fluoren-3-id-2-yl)quinoline;hexakis(iridium);phenyl-(6-phenyl-3-pyridinyl)methanone;1-(6-phenyl-3-pyridinyl)ethanone;phenyl-[6-(4-trimethylsilylbenzene-6-id-1-yl)-3-pyridinyl]methanone is CC(=O)c1ccc(-c2[c-]cccc2)nc1.CC(C)(C)c1ccc(C(=O)c2ccc(-c3[c-]cccc3)nc2)cc1.CC(C)C(=O)c1ccc(-c2[c-]cc(C(C)(C)C)cc2)nc1.CC1(C)c2cc(-c3ccc4ccccc4n3)[c-]cc2-c2ccc([Si](c3ccccc3)(c3ccccc3)c3ccccc3)cc21.CC1(C)c2ccccc2-c2c[c-]c(-c3ccc4ccccc4n3)cc21.CC1(C)c2ccccc2-c2c[c-]c(-c3ccc4ccccc4n3)cc21.CC1(C)c2ccccc2-c2c[c-]c(-c3ccc4ccccc4n3)cc21.CCCCCCCCC1(CCCCCCCC)c2ccccc2-c2c[c-]c(-c3ccc4ccccc4n3)cc21.CCc1ccc2c(c1)C(C)(C)c1cc(-c3ccc4ccccc4n3)[c-]cc1-2.C[Si](C)(C)c1c[c-]c(-c2ccc(C(=O)c3ccccc3)cn2)cc1.Cc1c[c-]c(-c2ccc(C(=O)C(C)(C)C)cn2)cc1.O=C(c1ccccc1)c1ccc(-c2[c-]cccc2)nc1.[Ir].[Ir].[Ir].[Ir].[Ir].[Ir].
What is the InChIKey of 1-[6-(4-tert-butylbenzene-6-id-1-yl)-3-pyridinyl]-2-methylpropan-1-one;(4-tert-butylphenyl)-(6-phenyl-3-pyridinyl)methanone;tris(2-(9,9-dimethyl-3H-fluoren-3-id-2-yl)quinoline);2,2-dimethyl-1-[6-(4-methylbenzene-6-id-1-yl)-3-pyridinyl]propan-1-one;(9,9-dimethyl-7-quinolin-2-yl-6H-fluoren-6-id-2-yl)-triphenylsilane;2-(9,9-dioctyl-3H-fluoren-3-id-2-yl)quinoline;2-(7-ethyl-9,9-dimethyl-3H-fluoren-3-id-2-yl)quinoline;hexakis(iridium);phenyl-(6-phenyl-3-pyridinyl)methanone;1-(6-phenyl-3-pyridinyl)ethanone;phenyl-[6-(4-trimethylsilylbenzene-6-id-1-yl)-3-pyridinyl]methanone?
The InChIKey is GFIPWXAEMTXMAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C42H32NSi.C38H46N.C26H22N.3C24H18N.C22H20NO.C21H20NOSi.C19H22NO.C18H12NO.C17H18NO.C13H10NO.6Ir/c1-42(2)38-28-31(41-27-23-30-14-12-13-21-40(30)43-41)22-25-36(38)37-26-24-35(29-39(37)42)44(32-15-6-3-7-16-32,33-17-8-4-9-18-33)34-19-10-5-11-20-34;1-3-5-7-9-11-17-27-38(28-18-12-10-8-6-4-2)34-21-15-14-20-32(34)33-25-23-31(29-35(33)38)37-26-24-30-19-13-16-22-36(30)39-37;1-4-17-9-12-20-21-13-10-19(16-23(21)26(2,3)22(20)15-17)25-14-11-18-7-5-6-8-24(18)27-25;3*1-24(2)20-9-5-4-8-18(20)19-13-11-17(15-21(19)24)23-14-12-16-7-3-6-10-22(16)25-23;1-22(2,3)19-12-9-17(10-13-19)21(24)18-11-14-20(23-15-18)16-7-5-4-6-8-16;1-24(2,3)19-12-9-16(10-13-19)20-14-11-18(15-22-20)21(23)17-7-5-4-6-8-17;1-13(2)18(21)15-8-11-17(20-12-15)14-6-9-16(10-7-14)19(3,4)5;20-18(15-9-5-2-6-10-15)16-11-12-17(19-13-16)14-7-3-1-4-8-14;1-12-5-7-13(8-6-12)15-10-9-14(11-18-15)16(19)17(2,3)4;1-10(15)12-7-8-13(14-9-12)11-5-3-2-4-6-11;;;;;;/h3-21,23-29H,1-2H3;13-16,19-22,24-26,29H,3-12,17-18,27-28H2,1-2H3;5-9,11-16H,4H2,1-3H3;3*3-10,12-15H,1-2H3;4-7,9-15H,1-3H3;4-9,11-15H,1-3H3;6,8-13H,1-5H3;1-7,9-13H;5-7,9-11H,1-4H3;2-5,7-9H,1H3;;;;;;/q12*-1;;;;;;.
What are the key properties of 1-[6-(4-tert-butylbenzene-6-id-1-yl)-3-pyridinyl]-2-methylpropan-1-one;(4-tert-butylphenyl)-(6-phenyl-3-pyridinyl)methanone;tris(2-(9,9-dimethyl-3H-fluoren-3-id-2-yl)quinoline);2,2-dimethyl-1-[6-(4-methylbenzene-6-id-1-yl)-3-pyridinyl]propan-1-one;(9,9-dimethyl-7-quinolin-2-yl-6H-fluoren-6-id-2-yl)-triphenylsilane;2-(9,9-dioctyl-3H-fluoren-3-id-2-yl)quinoline;2-(7-ethyl-9,9-dimethyl-3H-fluoren-3-id-2-yl)quinoline;hexakis(iridium);phenyl-(6-phenyl-3-pyridinyl)methanone;1-(6-phenyl-3-pyridinyl)ethanone;phenyl-[6-(4-trimethylsilylbenzene-6-id-1-yl)-3-pyridinyl]methanone?
1-[6-(4-tert-butylbenzene-6-id-1-yl)-3-pyridinyl]-2-methylpropan-1-one;(4-tert-butylphenyl)-(6-phenyl-3-pyridinyl)methanone;tris(2-(9,9-dimethyl-3H-fluoren-3-id-2-yl)quinoline);2,2-dimethyl-1-[6-(4-methylbenzene-6-id-1-yl)-3-pyridinyl]propan-1-one;(9,9-dimethyl-7-quinolin-2-yl-6H-fluoren-6-id-2-yl)-triphenylsilane;2-(9,9-dioctyl-3H-fluoren-3-id-2-yl)quinoline;2-(7-ethyl-9,9-dimethyl-3H-fluoren-3-id-2-yl)quinoline;hexakis(iridium);phenyl-(6-phenyl-3-pyridinyl)methanone;1-(6-phenyl-3-pyridinyl)ethanone;phenyl-[6-(4-trimethylsilylbenzene-6-id-1-yl)-3-pyridinyl]methanone has a molecular weight of 5190.77 g/mol, XLogP of 68.14, 42 rotatable bonds, 0 hydrogen bond donors, and 18 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[6-(4-tert-butylbenzene-6-id-1-yl)-3-pyridinyl]-2-methylpropan-1-one;(4-tert-butylphenyl)-(6-phenyl-3-pyridinyl)methanone;tris(2-(9,9-dimethyl-3H-fluoren-3-id-2-yl)quinoline);2,2-dimethyl-1-[6-(4-methylbenzene-6-id-1-yl)-3-pyridinyl]propan-1-one;(9,9-dimethyl-7-quinolin-2-yl-6H-fluoren-6-id-2-yl)-triphenylsilane;2-(9,9-dioctyl-3H-fluoren-3-id-2-yl)quinoline;2-(7-ethyl-9,9-dimethyl-3H-fluoren-3-id-2-yl)quinoline;hexakis(iridium);phenyl-(6-phenyl-3-pyridinyl)methanone;1-(6-phenyl-3-pyridinyl)ethanone;phenyl-[6-(4-trimethylsilylbenzene-6-id-1-yl)-3-pyridinyl]methanone is sourced from PubChem (CID 157426080), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).