bis(bis(3,4-dimethylphenyl)-dimethylsilane);bis(3,4-dimethylphenyl)methanol;[4-(3,4-dimethylbenzoyl)phenyl]-(3,4-dimethylphenyl)methanone;4-[4-(3,4-dimethylphenoxy)phenoxy]-1,2-dimethylbenzene;N-(3,4-dimethylphenyl)-3,4-dimethylbenzamide;(2,3-dimethylphenyl)-(3,4-dimethylphenyl)methanol;4-(3,4-dimethylphenyl)sulfonyl-1,2-dimethylbenzene;methane

C157H201NO9SSi2 — CID 157311590

IUPACbis(bis(3,4-dimethylphenyl)-dimethylsilane);bis(3,4-dimethylphenyl)methanol;[4-(3,4-dimethylbenzoyl)phenyl]-(3,4-dimethylphenyl)methanone;4-[4-(3,4-dimethylphenoxy)phenoxy]-1,2-dimethylbenzene;N-(3,4-dimethylphenyl)-3,4-dimethylbenzamide;(2,3-dimethylphenyl)-(3,4-dimethylphenyl)methanol;4-(3,4-dimethylphenyl)sulfonyl-1,2-dimethylbenzene;methane
SMILESC.C.C.C.C.C.C.C.Cc1ccc(C(=O)c2ccc(C(=O)c3ccc(C)c(C)c3)cc2)cc1C.Cc1ccc(C(O)c2ccc(C)c(C)c2)cc1C.Cc1ccc(C(O)c2cccc(C)c2C)cc1C.Cc1ccc(NC(=O)c2ccc(C)c(C)c2)cc1C.Cc1ccc(Oc2ccc(Oc3ccc(C)c(C)c3)cc2)cc1C.Cc1ccc(S(=O)(=O)c2ccc(C)c(C)c2)cc1C.Cc1ccc([Si](C)(C)c2ccc(C)c(C)c2)cc1C.Cc1ccc([Si](C)(C)c2ccc(C)c(C)c2)cc1C
InChIInChI=1S/C24H22O2.C22H22O2.2C18H24Si.C17H19NO.2C17H20O.C16H18O2S.8CH4/c1-15-5-7-21(13-17(15)3)23(25)19-9-11-20(12-10-19)24(26)22-8-6-16(2)18(4)14-22;1-15-5-7-21(13-17(15)3)23-19-9-11-20(12-10-19)24-22-8-6-16(2)18(4)14-22;2*1-13-7-9-17(11-15(13)3)19(5,6)18-10-8-14(2)16(4)12-18;1-11-5-7-15(9-13(11)3)17(19)18-16-8-6-12(2)14(4)10-16;1-11-5-7-15(9-13(11)3)17(18)16-8-6-12(2)14(4)10-16;1-11-8-9-15(10-13(11)3)17(18)16-7-5-6-12(2)14(16)4;1-11-5-7-15(9-13(11)3)19(17,18)16-8-6-12(2)14(4)10-16;;;;;;;;/h5-14H,1-4H3;5-14H,1-4H3;2*7-12H,1-6H3;5-10H,1-4H3,(H,18,19);2*5-10,17-18H,1-4H3;5-10H,1-4H3;8*1H4
InChIKeyBDCIXPKVKORVEU-UHFFFAOYSA-N
MW2334.57 g/mol
LogP40.39
Rot. Bonds20

About bis(bis(3,4-dimethylphenyl)-dimethylsilane);bis(3,4-dimethylphenyl)methanol;[4-(3,4-dimethylbenzoyl)phenyl]-(3,4-dimethylphenyl)methanone;4-[4-(3,4-dimethylphenoxy)phenoxy]-1,2-dimethylbenzene;N-(3,4-dimethylphenyl)-3,4-dimethylbenzamide;(2,3-dimethylphenyl)-(3,4-dimethylphenyl)methanol;4-(3,4-dimethylphenyl)sulfonyl-1,2-dimethylbenzene;methane

bis(bis(3,4-dimethylphenyl)-dimethylsilane);bis(3,4-dimethylphenyl)methanol;[4-(3,4-dimethylbenzoyl)phenyl]-(3,4-dimethylphenyl)methanone;4-[4-(3,4-dimethylphenoxy)phenoxy]-1,2-dimethylbenzene;N-(3,4-dimethylphenyl)-3,4-dimethylbenzamide;(2,3-dimethylphenyl)-(3,4-dimethylphenyl)methanol;4-(3,4-dimethylphenyl)sulfonyl-1,2-dimethylbenzene;methane (PubChem CID 157311590) has the molecular formula C157H201NO9SSi2 and a molecular weight of 2334.57 g/mol. Its IUPAC name is bis(bis(3,4-dimethylphenyl)-dimethylsilane);bis(3,4-dimethylphenyl)methanol;[4-(3,4-dimethylbenzoyl)phenyl]-(3,4-dimethylphenyl)methanone;4-[4-(3,4-dimethylphenoxy)phenoxy]-1,2-dimethylbenzene;N-(3,4-dimethylphenyl)-3,4-dimethylbenzamide;(2,3-dimethylphenyl)-(3,4-dimethylphenyl)methanol;4-(3,4-dimethylphenyl)sulfonyl-1,2-dimethylbenzene;methane.

Molecular Properties

Compound Namebis(bis(3,4-dimethylphenyl)-dimethylsilane);bis(3,4-dimethylphenyl)methanol;[4-(3,4-dimethylbenzoyl)phenyl]-(3,4-dimethylphenyl)methanone;4-[4-(3,4-dimethylphenoxy)phenoxy]-1,2-dimethylbenzene;N-(3,4-dimethylphenyl)-3,4-dimethylbenzamide;(2,3-dimethylphenyl)-(3,4-dimethylphenyl)methanol;4-(3,4-dimethylphenyl)sulfonyl-1,2-dimethylbenzene;methane
PubChem CID157311590
Molecular FormulaC157H201NO9SSi2
Molecular Weight2334.57 g/mol
Exact Mass2332.46
IUPAC Namebis(bis(3,4-dimethylphenyl)-dimethylsilane);bis(3,4-dimethylphenyl)methanol;[4-(3,4-dimethylbenzoyl)phenyl]-(3,4-dimethylphenyl)methanone;4-[4-(3,4-dimethylphenoxy)phenoxy]-1,2-dimethylbenzene;N-(3,4-dimethylphenyl)-3,4-dimethylbenzamide;(2,3-dimethylphenyl)-(3,4-dimethylphenyl)methanol;4-(3,4-dimethylphenyl)sulfonyl-1,2-dimethylbenzene;methane
SMILESC.C.C.C.C.C.C.C.Cc1ccc(C(=O)c2ccc(C(=O)c3ccc(C)c(C)c3)cc2)cc1C.Cc1ccc(C(O)c2ccc(C)c(C)c2)cc1C.Cc1ccc(C(O)c2cccc(C)c2C)cc1C.Cc1ccc(NC(=O)c2ccc(C)c(C)c2)cc1C.Cc1ccc(Oc2ccc(Oc3ccc(C)c(C)c3)cc2)cc1C.Cc1ccc(S(=O)(=O)c2ccc(C)c(C)c2)cc1C.Cc1ccc([Si](C)(C)c2ccc(C)c(C)c2)cc1C.Cc1ccc([Si](C)(C)c2ccc(C)c(C)c2)cc1C
InChIInChI=1S/C24H22O2.C22H22O2.2C18H24Si.C17H19NO.2C17H20O.C16H18O2S.8CH4/c1-15-5-7-21(13-17(15)3)23(25)19-9-11-20(12-10-19)24(26)22-8-6-16(2)18(4)14-22;1-15-5-7-21(13-17(15)3)23-19-9-11-20(12-10-19)24-22-8-6-16(2)18(4)14-22;2*1-13-7-9-17(11-15(13)3)19(5,6)18-10-8-14(2)16(4)12-18;1-11-5-7-15(9-13(11)3)17(19)18-16-8-6-12(2)14(4)10-16;1-11-5-7-15(9-13(11)3)17(18)16-8-6-12(2)14(4)10-16;1-11-8-9-15(10-13(11)3)17(18)16-7-5-6-12(2)14(16)4;1-11-5-7-15(9-13(11)3)19(17,18)16-8-6-12(2)14(4)10-16;;;;;;;;/h5-14H,1-4H3;5-14H,1-4H3;2*7-12H,1-6H3;5-10H,1-4H3,(H,18,19);2*5-10,17-18H,1-4H3;5-10H,1-4H3;8*1H4
InChIKeyBDCIXPKVKORVEU-UHFFFAOYSA-N
XLogP40.39
TPSA156.30 Ų
H-Bond Donors3
H-Bond Acceptors9
Rotatable Bonds20
Heavy Atoms170
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002334.57
LogP ≤ 540.39
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 109

Computed Properties (RDKit)

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

Analyze bis(bis(3,4-dimethylphenyl)-dimethylsilane);bis(3,4-dimethylphenyl)methanol;[4-(3,4-dimethylbenzoyl)phenyl]-(3,4-dimethylphenyl)methanone;4-[4-(3,4-dimethylphenoxy)phenoxy]-1,2-dimethylbenzene;N-(3,4-dimethylphenyl)-3,4-dimethylbenzamide;(2,3-dimethylphenyl)-(3,4-dimethylphenyl)methanol;4-(3,4-dimethylphenyl)sulfonyl-1,2-dimethylbenzene;methane with MolForge

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Related Compounds

bis(bis(3,4-dimethylphenyl)-dimethylsilane);bis(3,4-dimethylphenyl)methanol;4-[4-(3,4-dimethylphenoxy)phenoxy]-1,2-dimethylbenzene;N-(2,4-dimethylphenyl)-3,4-dimethylbenzamide;N-(3,4-dimethylphenyl)-3,4-dimethylbenzamide;N-(3,5-dimethylphenyl)-3,4-dimethylbenzamide;(3,4-dimethylphenyl)-(3,5-dimethylphenyl)-dimethylsilane;(2,3-dimethylphenyl)-(3,4-dimethylphenyl)methanol;(2,5-dimethylphenyl)-(3,4-dimethylphenyl)methanol;(3,4-dimethylphenyl)-(3,5-dimethylphenyl)methanol
CID 159911759
tetrakis(bis(3,4-dimethylphenyl)methanone);tetrakis(4-(3,4-dimethylphenoxy)-1,2-dimethylbenzene);tris(4-(3,4-dimethylphenyl)sulfonyl-1,2-dimethylbenzene)
CID 157174733
bis(3,4-dimethylphenyl)methanone;4-(3,4-dimethylphenoxy)-1,2-dimethylbenzene;4-[4-(3,4-dimethylphenoxy)phenoxy]-1,2-dimethylbenzene;4-(3,4-dimethylphenyl)-1,2-dimethylbenzene;4-[2-(3,4-dimethylphenyl)-1,1,1,3,3,3-hexafluoropropan-2-yl]-1,2-dimethylbenzene;4-(3,4-dimethylphenyl)sulfonyl-1,2-dimethylbenzene;1,2,4,5-tetramethylbenzene
CID 159397283
1,4-bis(3-methylphenoxy)benzene;1,4-bis(4-methylphenoxy)benzene;dimethyl-bis(3-methylphenyl)silane;dimethyl-bis(4-methylphenyl)silane;methane;3-methyl-N-(3-methylphenyl)benzamide;3-methyl-N-(4-methylphenyl)benzamide;4-methyl-N-(3-methylphenyl)benzamide;4-methyl-N-(4-methylphenyl)benzamide
CID 159103853
bis(3,4-dimethylphenyl)methanone;4-(3,4-dimethylphenoxy)-1,2-dimethylbenzene;1,2,4,5-tetramethylbenzene
CID 159619159
[3-[4-[4-(3-benzoylphenoxy)phenyl]sulfonylphenoxy]phenyl]-phenylmethanone
CID 175364339
1,1'-biphenyl;bis(3,4-dimethylphenyl)methanone;4-(3,4-dimethylphenoxy)-1,2-dimethylbenzene;4-[4-(3,4-dimethylphenoxy)phenoxy]-1,2-dimethylbenzene;4-[4-[2-[4-(3,4-dimethylphenoxy)phenyl]propan-2-yl]phenoxy]-1,2-dimethylbenzene;4-[2-(3,4-dimethylphenyl)-1,1,1,3,3,3-hexafluoropropan-2-yl]-1,2-dimethylbenzene;4-[2-(3,4-dimethylphenyl)propan-2-yl]-1,2-dimethylbenzene;4-(3,4-dimethylphenyl)sulfonyl-1,2-dimethylbenzene;ethane;naphthalene;1,2,4,5-tetramethylbenzene
CID 158595488
(3,4-dimethylphenyl)-[4-[4-[2-[4-[4-[4-[4-[2-(4-methoxyphenyl)propan-2-yl]phenoxy]phenyl]sulfonylphenoxy]phenyl]propan-2-yl]phenoxy]-3-methylphenyl]methanone;[4-[4-[2-[4-[4-(3,4-dimethylphenyl)sulfonyl-2-methylphenoxy]phenyl]propan-2-yl]phenoxy]phenyl]-[4-[4-[2-(4-methoxyphenyl)propan-2-yl]phenoxy]phenyl]methanone;ethane;methane
CID 159868198
N-(3,4-dimethylphenyl)-4-[(4-methoxyphenyl)sulfamoyl]benzamide
CID 26593901
[4-[4-[2-[4-[4-(3,4-dimethylphenyl)sulfonyl-2-methylphenoxy]phenyl]propan-2-yl]phenoxy]phenyl]-[4-[4-[2-(4-methoxyphenyl)propan-2-yl]phenoxy]phenyl]methanone
CID 59132534
[4-[4-[2-[4-[4-(3,4-dimethylphenyl)sulfonyl-2-methylphenoxy]phenyl]propan-2-yl]phenoxy]phenyl]-(4-methylphenyl)methanone;ethane
CID 90983097
N-[4-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]phenyl]-3-phenoxybenzamide
CID 2141409

Frequently Asked Questions

What is the IUPAC name of bis(bis(3,4-dimethylphenyl)-dimethylsilane);bis(3,4-dimethylphenyl)methanol;[4-(3,4-dimethylbenzoyl)phenyl]-(3,4-dimethylphenyl)methanone;4-[4-(3,4-dimethylphenoxy)phenoxy]-1,2-dimethylbenzene;N-(3,4-dimethylphenyl)-3,4-dimethylbenzamide;(2,3-dimethylphenyl)-(3,4-dimethylphenyl)methanol;4-(3,4-dimethylphenyl)sulfonyl-1,2-dimethylbenzene;methane?
The IUPAC name of bis(bis(3,4-dimethylphenyl)-dimethylsilane);bis(3,4-dimethylphenyl)methanol;[4-(3,4-dimethylbenzoyl)phenyl]-(3,4-dimethylphenyl)methanone;4-[4-(3,4-dimethylphenoxy)phenoxy]-1,2-dimethylbenzene;N-(3,4-dimethylphenyl)-3,4-dimethylbenzamide;(2,3-dimethylphenyl)-(3,4-dimethylphenyl)methanol;4-(3,4-dimethylphenyl)sulfonyl-1,2-dimethylbenzene;methane (CID 157311590) is bis(bis(3,4-dimethylphenyl)-dimethylsilane);bis(3,4-dimethylphenyl)methanol;[4-(3,4-dimethylbenzoyl)phenyl]-(3,4-dimethylphenyl)methanone;4-[4-(3,4-dimethylphenoxy)phenoxy]-1,2-dimethylbenzene;N-(3,4-dimethylphenyl)-3,4-dimethylbenzamide;(2,3-dimethylphenyl)-(3,4-dimethylphenyl)methanol;4-(3,4-dimethylphenyl)sulfonyl-1,2-dimethylbenzene;methane.
What is the SMILES notation for bis(bis(3,4-dimethylphenyl)-dimethylsilane);bis(3,4-dimethylphenyl)methanol;[4-(3,4-dimethylbenzoyl)phenyl]-(3,4-dimethylphenyl)methanone;4-[4-(3,4-dimethylphenoxy)phenoxy]-1,2-dimethylbenzene;N-(3,4-dimethylphenyl)-3,4-dimethylbenzamide;(2,3-dimethylphenyl)-(3,4-dimethylphenyl)methanol;4-(3,4-dimethylphenyl)sulfonyl-1,2-dimethylbenzene;methane?
The canonical SMILES for bis(bis(3,4-dimethylphenyl)-dimethylsilane);bis(3,4-dimethylphenyl)methanol;[4-(3,4-dimethylbenzoyl)phenyl]-(3,4-dimethylphenyl)methanone;4-[4-(3,4-dimethylphenoxy)phenoxy]-1,2-dimethylbenzene;N-(3,4-dimethylphenyl)-3,4-dimethylbenzamide;(2,3-dimethylphenyl)-(3,4-dimethylphenyl)methanol;4-(3,4-dimethylphenyl)sulfonyl-1,2-dimethylbenzene;methane is C.C.C.C.C.C.C.C.Cc1ccc(C(=O)c2ccc(C(=O)c3ccc(C)c(C)c3)cc2)cc1C.Cc1ccc(C(O)c2ccc(C)c(C)c2)cc1C.Cc1ccc(C(O)c2cccc(C)c2C)cc1C.Cc1ccc(NC(=O)c2ccc(C)c(C)c2)cc1C.Cc1ccc(Oc2ccc(Oc3ccc(C)c(C)c3)cc2)cc1C.Cc1ccc(S(=O)(=O)c2ccc(C)c(C)c2)cc1C.Cc1ccc([Si](C)(C)c2ccc(C)c(C)c2)cc1C.Cc1ccc([Si](C)(C)c2ccc(C)c(C)c2)cc1C.
What is the InChIKey of bis(bis(3,4-dimethylphenyl)-dimethylsilane);bis(3,4-dimethylphenyl)methanol;[4-(3,4-dimethylbenzoyl)phenyl]-(3,4-dimethylphenyl)methanone;4-[4-(3,4-dimethylphenoxy)phenoxy]-1,2-dimethylbenzene;N-(3,4-dimethylphenyl)-3,4-dimethylbenzamide;(2,3-dimethylphenyl)-(3,4-dimethylphenyl)methanol;4-(3,4-dimethylphenyl)sulfonyl-1,2-dimethylbenzene;methane?
The InChIKey is BDCIXPKVKORVEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H22O2.C22H22O2.2C18H24Si.C17H19NO.2C17H20O.C16H18O2S.8CH4/c1-15-5-7-21(13-17(15)3)23(25)19-9-11-20(12-10-19)24(26)22-8-6-16(2)18(4)14-22;1-15-5-7-21(13-17(15)3)23-19-9-11-20(12-10-19)24-22-8-6-16(2)18(4)14-22;2*1-13-7-9-17(11-15(13)3)19(5,6)18-10-8-14(2)16(4)12-18;1-11-5-7-15(9-13(11)3)17(19)18-16-8-6-12(2)14(4)10-16;1-11-5-7-15(9-13(11)3)17(18)16-8-6-12(2)14(4)10-16;1-11-8-9-15(10-13(11)3)17(18)16-7-5-6-12(2)14(16)4;1-11-5-7-15(9-13(11)3)19(17,18)16-8-6-12(2)14(4)10-16;;;;;;;;/h5-14H,1-4H3;5-14H,1-4H3;2*7-12H,1-6H3;5-10H,1-4H3,(H,18,19);2*5-10,17-18H,1-4H3;5-10H,1-4H3;8*1H4.
What are the key properties of bis(bis(3,4-dimethylphenyl)-dimethylsilane);bis(3,4-dimethylphenyl)methanol;[4-(3,4-dimethylbenzoyl)phenyl]-(3,4-dimethylphenyl)methanone;4-[4-(3,4-dimethylphenoxy)phenoxy]-1,2-dimethylbenzene;N-(3,4-dimethylphenyl)-3,4-dimethylbenzamide;(2,3-dimethylphenyl)-(3,4-dimethylphenyl)methanol;4-(3,4-dimethylphenyl)sulfonyl-1,2-dimethylbenzene;methane?
bis(bis(3,4-dimethylphenyl)-dimethylsilane);bis(3,4-dimethylphenyl)methanol;[4-(3,4-dimethylbenzoyl)phenyl]-(3,4-dimethylphenyl)methanone;4-[4-(3,4-dimethylphenoxy)phenoxy]-1,2-dimethylbenzene;N-(3,4-dimethylphenyl)-3,4-dimethylbenzamide;(2,3-dimethylphenyl)-(3,4-dimethylphenyl)methanol;4-(3,4-dimethylphenyl)sulfonyl-1,2-dimethylbenzene;methane has a molecular weight of 2334.57 g/mol, XLogP of 40.39, 20 rotatable bonds, 3 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for bis(bis(3,4-dimethylphenyl)-dimethylsilane);bis(3,4-dimethylphenyl)methanol;[4-(3,4-dimethylbenzoyl)phenyl]-(3,4-dimethylphenyl)methanone;4-[4-(3,4-dimethylphenoxy)phenoxy]-1,2-dimethylbenzene;N-(3,4-dimethylphenyl)-3,4-dimethylbenzamide;(2,3-dimethylphenyl)-(3,4-dimethylphenyl)methanol;4-(3,4-dimethylphenyl)sulfonyl-1,2-dimethylbenzene;methane is sourced from PubChem (CID 157311590), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).