bis(3,4-dimethylphenyl)methanone;1-(3,4-dimethylphenoxy)-2,3-dimethylbenzene;4-(3,4-dimethylphenoxy)-1,2-dimethylbenzene;1-[(3,4-dimethylphenyl)-difluoromethyl]-2,3-dimethylbenzene;4-[(3,4-dimethylphenyl)-difluoromethyl]-1,2-dimethylbenzene;1-[(3,4-dimethylphenyl)methyl]-2,3-dimethylbenzene;4-[(3,4-dimethylphenyl)methyl]-1,2-dimethylbenzene;4-[4-(3,4-dimethylphenyl)phenyl]-1,2-dimethylbenzene;1-(3,4-dimethylphenyl)sulfanyl-2,3-dimethylbenzene;4-(3,4-dimethylphenyl)sulfanyl-1,2-dimethylbenzene;1,2,4,5-tetramethyl-3,6-diphenylbenzene

C193H210F4O3S2 — CID 158330322

IUPACbis(3,4-dimethylphenyl)methanone;1-(3,4-dimethylphenoxy)-2,3-dimethylbenzene;4-(3,4-dimethylphenoxy)-1,2-dimethylbenzene;1-[(3,4-dimethylphenyl)-difluoromethyl]-2,3-dimethylbenzene;4-[(3,4-dimethylphenyl)-difluoromethyl]-1,2-dimethylbenzene;1-[(3,4-dimethylphenyl)methyl]-2,3-dimethylbenzene;4-[(3,4-dimethylphenyl)methyl]-1,2-dimethylbenzene;4-[4-(3,4-dimethylphenyl)phenyl]-1,2-dimethylbenzene;1-(3,4-dimethylphenyl)sulfanyl-2,3-dimethylbenzene;4-(3,4-dimethylphenyl)sulfanyl-1,2-dimethylbenzene;1,2,4,5-tetramethyl-3,6-diphenylbenzene
SMILESCc1c(C)c(-c2ccccc2)c(C)c(C)c1-c1ccccc1.Cc1ccc(-c2ccc(-c3ccc(C)c(C)c3)cc2)cc1C.Cc1ccc(C(=O)c2ccc(C)c(C)c2)cc1C.Cc1ccc(C(F)(F)c2ccc(C)c(C)c2)cc1C.Cc1ccc(C(F)(F)c2cccc(C)c2C)cc1C.Cc1ccc(Cc2ccc(C)c(C)c2)cc1C.Cc1ccc(Cc2cccc(C)c2C)cc1C.Cc1ccc(Oc2ccc(C)c(C)c2)cc1C.Cc1ccc(Oc2cccc(C)c2C)cc1C.Cc1ccc(Sc2ccc(C)c(C)c2)cc1C.Cc1ccc(Sc2cccc(C)c2C)cc1C
InChIInChI=1S/2C22H22.2C17H18F2.C17H18O.2C17H20.2C16H18O.2C16H18S/c1-15-5-7-21(13-17(15)3)19-9-11-20(12-10-19)22-8-6-16(2)18(4)14-22;1-15-16(2)22(20-13-9-6-10-14-20)18(4)17(3)21(15)19-11-7-5-8-12-19;1-11-5-7-15(9-13(11)3)17(18,19)16-8-6-12(2)14(4)10-16;1-11-8-9-15(10-13(11)3)17(18,19)16-7-5-6-12(2)14(16)4;1-11-5-7-15(9-13(11)3)17(18)16-8-6-12(2)14(4)10-16;1-12-5-7-16(9-14(12)3)11-17-8-6-13(2)15(4)10-17;1-12-8-9-16(10-14(12)3)11-17-7-5-6-13(2)15(17)4;1-11-5-7-15(9-13(11)3)17-16-8-6-12(2)14(4)10-16;1-11-8-9-15(10-13(11)3)17-16-7-5-6-12(2)14(16)4;1-11-5-7-15(9-13(11)3)17-16-8-6-12(2)14(4)10-16;1-11-8-9-15(10-13(11)3)17-16-7-5-6-12(2)14(16)4/h2*5-14H,1-4H3;2*5-10H,1-4H3;5-10H,1-4H3;2*5-10H,11H2,1-4H3;4*5-10H,1-4H3
InChIKeyGPXPKDMFPRKEKM-UHFFFAOYSA-N
MW2717.93 g/mol
LogP55.37
Rot. Bonds22

About bis(3,4-dimethylphenyl)methanone;1-(3,4-dimethylphenoxy)-2,3-dimethylbenzene;4-(3,4-dimethylphenoxy)-1,2-dimethylbenzene;1-[(3,4-dimethylphenyl)-difluoromethyl]-2,3-dimethylbenzene;4-[(3,4-dimethylphenyl)-difluoromethyl]-1,2-dimethylbenzene;1-[(3,4-dimethylphenyl)methyl]-2,3-dimethylbenzene;4-[(3,4-dimethylphenyl)methyl]-1,2-dimethylbenzene;4-[4-(3,4-dimethylphenyl)phenyl]-1,2-dimethylbenzene;1-(3,4-dimethylphenyl)sulfanyl-2,3-dimethylbenzene;4-(3,4-dimethylphenyl)sulfanyl-1,2-dimethylbenzene;1,2,4,5-tetramethyl-3,6-diphenylbenzene

bis(3,4-dimethylphenyl)methanone;1-(3,4-dimethylphenoxy)-2,3-dimethylbenzene;4-(3,4-dimethylphenoxy)-1,2-dimethylbenzene;1-[(3,4-dimethylphenyl)-difluoromethyl]-2,3-dimethylbenzene;4-[(3,4-dimethylphenyl)-difluoromethyl]-1,2-dimethylbenzene;1-[(3,4-dimethylphenyl)methyl]-2,3-dimethylbenzene;4-[(3,4-dimethylphenyl)methyl]-1,2-dimethylbenzene;4-[4-(3,4-dimethylphenyl)phenyl]-1,2-dimethylbenzene;1-(3,4-dimethylphenyl)sulfanyl-2,3-dimethylbenzene;4-(3,4-dimethylphenyl)sulfanyl-1,2-dimethylbenzene;1,2,4,5-tetramethyl-3,6-diphenylbenzene (PubChem CID 158330322) has the molecular formula C193H210F4O3S2 and a molecular weight of 2717.93 g/mol. Its IUPAC name is bis(3,4-dimethylphenyl)methanone;1-(3,4-dimethylphenoxy)-2,3-dimethylbenzene;4-(3,4-dimethylphenoxy)-1,2-dimethylbenzene;1-[(3,4-dimethylphenyl)-difluoromethyl]-2,3-dimethylbenzene;4-[(3,4-dimethylphenyl)-difluoromethyl]-1,2-dimethylbenzene;1-[(3,4-dimethylphenyl)methyl]-2,3-dimethylbenzene;4-[(3,4-dimethylphenyl)methyl]-1,2-dimethylbenzene;4-[4-(3,4-dimethylphenyl)phenyl]-1,2-dimethylbenzene;1-(3,4-dimethylphenyl)sulfanyl-2,3-dimethylbenzene;4-(3,4-dimethylphenyl)sulfanyl-1,2-dimethylbenzene;1,2,4,5-tetramethyl-3,6-diphenylbenzene.

Molecular Properties

Compound Namebis(3,4-dimethylphenyl)methanone;1-(3,4-dimethylphenoxy)-2,3-dimethylbenzene;4-(3,4-dimethylphenoxy)-1,2-dimethylbenzene;1-[(3,4-dimethylphenyl)-difluoromethyl]-2,3-dimethylbenzene;4-[(3,4-dimethylphenyl)-difluoromethyl]-1,2-dimethylbenzene;1-[(3,4-dimethylphenyl)methyl]-2,3-dimethylbenzene;4-[(3,4-dimethylphenyl)methyl]-1,2-dimethylbenzene;4-[4-(3,4-dimethylphenyl)phenyl]-1,2-dimethylbenzene;1-(3,4-dimethylphenyl)sulfanyl-2,3-dimethylbenzene;4-(3,4-dimethylphenyl)sulfanyl-1,2-dimethylbenzene;1,2,4,5-tetramethyl-3,6-diphenylbenzene
PubChem CID158330322
Molecular FormulaC193H210F4O3S2
Molecular Weight2717.93 g/mol
Exact Mass2715.57
IUPAC Namebis(3,4-dimethylphenyl)methanone;1-(3,4-dimethylphenoxy)-2,3-dimethylbenzene;4-(3,4-dimethylphenoxy)-1,2-dimethylbenzene;1-[(3,4-dimethylphenyl)-difluoromethyl]-2,3-dimethylbenzene;4-[(3,4-dimethylphenyl)-difluoromethyl]-1,2-dimethylbenzene;1-[(3,4-dimethylphenyl)methyl]-2,3-dimethylbenzene;4-[(3,4-dimethylphenyl)methyl]-1,2-dimethylbenzene;4-[4-(3,4-dimethylphenyl)phenyl]-1,2-dimethylbenzene;1-(3,4-dimethylphenyl)sulfanyl-2,3-dimethylbenzene;4-(3,4-dimethylphenyl)sulfanyl-1,2-dimethylbenzene;1,2,4,5-tetramethyl-3,6-diphenylbenzene
SMILESCc1c(C)c(-c2ccccc2)c(C)c(C)c1-c1ccccc1.Cc1ccc(-c2ccc(-c3ccc(C)c(C)c3)cc2)cc1C.Cc1ccc(C(=O)c2ccc(C)c(C)c2)cc1C.Cc1ccc(C(F)(F)c2ccc(C)c(C)c2)cc1C.Cc1ccc(C(F)(F)c2cccc(C)c2C)cc1C.Cc1ccc(Cc2ccc(C)c(C)c2)cc1C.Cc1ccc(Cc2cccc(C)c2C)cc1C.Cc1ccc(Oc2ccc(C)c(C)c2)cc1C.Cc1ccc(Oc2cccc(C)c2C)cc1C.Cc1ccc(Sc2ccc(C)c(C)c2)cc1C.Cc1ccc(Sc2cccc(C)c2C)cc1C
InChIInChI=1S/2C22H22.2C17H18F2.C17H18O.2C17H20.2C16H18O.2C16H18S/c1-15-5-7-21(13-17(15)3)19-9-11-20(12-10-19)22-8-6-16(2)18(4)14-22;1-15-16(2)22(20-13-9-6-10-14-20)18(4)17(3)21(15)19-11-7-5-8-12-19;1-11-5-7-15(9-13(11)3)17(18,19)16-8-6-12(2)14(4)10-16;1-11-8-9-15(10-13(11)3)17(18,19)16-7-5-6-12(2)14(16)4;1-11-5-7-15(9-13(11)3)17(18)16-8-6-12(2)14(4)10-16;1-12-5-7-16(9-14(12)3)11-17-8-6-13(2)15(4)10-17;1-12-8-9-16(10-14(12)3)11-17-7-5-6-13(2)15(17)4;1-11-5-7-15(9-13(11)3)17-16-8-6-12(2)14(4)10-16;1-11-8-9-15(10-13(11)3)17-16-7-5-6-12(2)14(16)4;1-11-5-7-15(9-13(11)3)17-16-8-6-12(2)14(4)10-16;1-11-8-9-15(10-13(11)3)17-16-7-5-6-12(2)14(16)4/h2*5-14H,1-4H3;2*5-10H,1-4H3;5-10H,1-4H3;2*5-10H,11H2,1-4H3;4*5-10H,1-4H3
InChIKeyGPXPKDMFPRKEKM-UHFFFAOYSA-N
XLogP55.37
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds22
Heavy Atoms202
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002717.93
LogP ≤ 555.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze bis(3,4-dimethylphenyl)methanone;1-(3,4-dimethylphenoxy)-2,3-dimethylbenzene;4-(3,4-dimethylphenoxy)-1,2-dimethylbenzene;1-[(3,4-dimethylphenyl)-difluoromethyl]-2,3-dimethylbenzene;4-[(3,4-dimethylphenyl)-difluoromethyl]-1,2-dimethylbenzene;1-[(3,4-dimethylphenyl)methyl]-2,3-dimethylbenzene;4-[(3,4-dimethylphenyl)methyl]-1,2-dimethylbenzene;4-[4-(3,4-dimethylphenyl)phenyl]-1,2-dimethylbenzene;1-(3,4-dimethylphenyl)sulfanyl-2,3-dimethylbenzene;4-(3,4-dimethylphenyl)sulfanyl-1,2-dimethylbenzene;1,2,4,5-tetramethyl-3,6-diphenylbenzene with MolForge

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Frequently Asked Questions

What is the IUPAC name of bis(3,4-dimethylphenyl)methanone;1-(3,4-dimethylphenoxy)-2,3-dimethylbenzene;4-(3,4-dimethylphenoxy)-1,2-dimethylbenzene;1-[(3,4-dimethylphenyl)-difluoromethyl]-2,3-dimethylbenzene;4-[(3,4-dimethylphenyl)-difluoromethyl]-1,2-dimethylbenzene;1-[(3,4-dimethylphenyl)methyl]-2,3-dimethylbenzene;4-[(3,4-dimethylphenyl)methyl]-1,2-dimethylbenzene;4-[4-(3,4-dimethylphenyl)phenyl]-1,2-dimethylbenzene;1-(3,4-dimethylphenyl)sulfanyl-2,3-dimethylbenzene;4-(3,4-dimethylphenyl)sulfanyl-1,2-dimethylbenzene;1,2,4,5-tetramethyl-3,6-diphenylbenzene?
The IUPAC name of bis(3,4-dimethylphenyl)methanone;1-(3,4-dimethylphenoxy)-2,3-dimethylbenzene;4-(3,4-dimethylphenoxy)-1,2-dimethylbenzene;1-[(3,4-dimethylphenyl)-difluoromethyl]-2,3-dimethylbenzene;4-[(3,4-dimethylphenyl)-difluoromethyl]-1,2-dimethylbenzene;1-[(3,4-dimethylphenyl)methyl]-2,3-dimethylbenzene;4-[(3,4-dimethylphenyl)methyl]-1,2-dimethylbenzene;4-[4-(3,4-dimethylphenyl)phenyl]-1,2-dimethylbenzene;1-(3,4-dimethylphenyl)sulfanyl-2,3-dimethylbenzene;4-(3,4-dimethylphenyl)sulfanyl-1,2-dimethylbenzene;1,2,4,5-tetramethyl-3,6-diphenylbenzene (CID 158330322) is bis(3,4-dimethylphenyl)methanone;1-(3,4-dimethylphenoxy)-2,3-dimethylbenzene;4-(3,4-dimethylphenoxy)-1,2-dimethylbenzene;1-[(3,4-dimethylphenyl)-difluoromethyl]-2,3-dimethylbenzene;4-[(3,4-dimethylphenyl)-difluoromethyl]-1,2-dimethylbenzene;1-[(3,4-dimethylphenyl)methyl]-2,3-dimethylbenzene;4-[(3,4-dimethylphenyl)methyl]-1,2-dimethylbenzene;4-[4-(3,4-dimethylphenyl)phenyl]-1,2-dimethylbenzene;1-(3,4-dimethylphenyl)sulfanyl-2,3-dimethylbenzene;4-(3,4-dimethylphenyl)sulfanyl-1,2-dimethylbenzene;1,2,4,5-tetramethyl-3,6-diphenylbenzene.
What is the SMILES notation for bis(3,4-dimethylphenyl)methanone;1-(3,4-dimethylphenoxy)-2,3-dimethylbenzene;4-(3,4-dimethylphenoxy)-1,2-dimethylbenzene;1-[(3,4-dimethylphenyl)-difluoromethyl]-2,3-dimethylbenzene;4-[(3,4-dimethylphenyl)-difluoromethyl]-1,2-dimethylbenzene;1-[(3,4-dimethylphenyl)methyl]-2,3-dimethylbenzene;4-[(3,4-dimethylphenyl)methyl]-1,2-dimethylbenzene;4-[4-(3,4-dimethylphenyl)phenyl]-1,2-dimethylbenzene;1-(3,4-dimethylphenyl)sulfanyl-2,3-dimethylbenzene;4-(3,4-dimethylphenyl)sulfanyl-1,2-dimethylbenzene;1,2,4,5-tetramethyl-3,6-diphenylbenzene?
The canonical SMILES for bis(3,4-dimethylphenyl)methanone;1-(3,4-dimethylphenoxy)-2,3-dimethylbenzene;4-(3,4-dimethylphenoxy)-1,2-dimethylbenzene;1-[(3,4-dimethylphenyl)-difluoromethyl]-2,3-dimethylbenzene;4-[(3,4-dimethylphenyl)-difluoromethyl]-1,2-dimethylbenzene;1-[(3,4-dimethylphenyl)methyl]-2,3-dimethylbenzene;4-[(3,4-dimethylphenyl)methyl]-1,2-dimethylbenzene;4-[4-(3,4-dimethylphenyl)phenyl]-1,2-dimethylbenzene;1-(3,4-dimethylphenyl)sulfanyl-2,3-dimethylbenzene;4-(3,4-dimethylphenyl)sulfanyl-1,2-dimethylbenzene;1,2,4,5-tetramethyl-3,6-diphenylbenzene is Cc1c(C)c(-c2ccccc2)c(C)c(C)c1-c1ccccc1.Cc1ccc(-c2ccc(-c3ccc(C)c(C)c3)cc2)cc1C.Cc1ccc(C(=O)c2ccc(C)c(C)c2)cc1C.Cc1ccc(C(F)(F)c2ccc(C)c(C)c2)cc1C.Cc1ccc(C(F)(F)c2cccc(C)c2C)cc1C.Cc1ccc(Cc2ccc(C)c(C)c2)cc1C.Cc1ccc(Cc2cccc(C)c2C)cc1C.Cc1ccc(Oc2ccc(C)c(C)c2)cc1C.Cc1ccc(Oc2cccc(C)c2C)cc1C.Cc1ccc(Sc2ccc(C)c(C)c2)cc1C.Cc1ccc(Sc2cccc(C)c2C)cc1C.
What is the InChIKey of bis(3,4-dimethylphenyl)methanone;1-(3,4-dimethylphenoxy)-2,3-dimethylbenzene;4-(3,4-dimethylphenoxy)-1,2-dimethylbenzene;1-[(3,4-dimethylphenyl)-difluoromethyl]-2,3-dimethylbenzene;4-[(3,4-dimethylphenyl)-difluoromethyl]-1,2-dimethylbenzene;1-[(3,4-dimethylphenyl)methyl]-2,3-dimethylbenzene;4-[(3,4-dimethylphenyl)methyl]-1,2-dimethylbenzene;4-[4-(3,4-dimethylphenyl)phenyl]-1,2-dimethylbenzene;1-(3,4-dimethylphenyl)sulfanyl-2,3-dimethylbenzene;4-(3,4-dimethylphenyl)sulfanyl-1,2-dimethylbenzene;1,2,4,5-tetramethyl-3,6-diphenylbenzene?
The InChIKey is GPXPKDMFPRKEKM-UHFFFAOYSA-N. The full InChI is InChI=1S/2C22H22.2C17H18F2.C17H18O.2C17H20.2C16H18O.2C16H18S/c1-15-5-7-21(13-17(15)3)19-9-11-20(12-10-19)22-8-6-16(2)18(4)14-22;1-15-16(2)22(20-13-9-6-10-14-20)18(4)17(3)21(15)19-11-7-5-8-12-19;1-11-5-7-15(9-13(11)3)17(18,19)16-8-6-12(2)14(4)10-16;1-11-8-9-15(10-13(11)3)17(18,19)16-7-5-6-12(2)14(16)4;1-11-5-7-15(9-13(11)3)17(18)16-8-6-12(2)14(4)10-16;1-12-5-7-16(9-14(12)3)11-17-8-6-13(2)15(4)10-17;1-12-8-9-16(10-14(12)3)11-17-7-5-6-13(2)15(17)4;1-11-5-7-15(9-13(11)3)17-16-8-6-12(2)14(4)10-16;1-11-8-9-15(10-13(11)3)17-16-7-5-6-12(2)14(16)4;1-11-5-7-15(9-13(11)3)17-16-8-6-12(2)14(4)10-16;1-11-8-9-15(10-13(11)3)17-16-7-5-6-12(2)14(16)4/h2*5-14H,1-4H3;2*5-10H,1-4H3;5-10H,1-4H3;2*5-10H,11H2,1-4H3;4*5-10H,1-4H3.
What are the key properties of bis(3,4-dimethylphenyl)methanone;1-(3,4-dimethylphenoxy)-2,3-dimethylbenzene;4-(3,4-dimethylphenoxy)-1,2-dimethylbenzene;1-[(3,4-dimethylphenyl)-difluoromethyl]-2,3-dimethylbenzene;4-[(3,4-dimethylphenyl)-difluoromethyl]-1,2-dimethylbenzene;1-[(3,4-dimethylphenyl)methyl]-2,3-dimethylbenzene;4-[(3,4-dimethylphenyl)methyl]-1,2-dimethylbenzene;4-[4-(3,4-dimethylphenyl)phenyl]-1,2-dimethylbenzene;1-(3,4-dimethylphenyl)sulfanyl-2,3-dimethylbenzene;4-(3,4-dimethylphenyl)sulfanyl-1,2-dimethylbenzene;1,2,4,5-tetramethyl-3,6-diphenylbenzene?
bis(3,4-dimethylphenyl)methanone;1-(3,4-dimethylphenoxy)-2,3-dimethylbenzene;4-(3,4-dimethylphenoxy)-1,2-dimethylbenzene;1-[(3,4-dimethylphenyl)-difluoromethyl]-2,3-dimethylbenzene;4-[(3,4-dimethylphenyl)-difluoromethyl]-1,2-dimethylbenzene;1-[(3,4-dimethylphenyl)methyl]-2,3-dimethylbenzene;4-[(3,4-dimethylphenyl)methyl]-1,2-dimethylbenzene;4-[4-(3,4-dimethylphenyl)phenyl]-1,2-dimethylbenzene;1-(3,4-dimethylphenyl)sulfanyl-2,3-dimethylbenzene;4-(3,4-dimethylphenyl)sulfanyl-1,2-dimethylbenzene;1,2,4,5-tetramethyl-3,6-diphenylbenzene has a molecular weight of 2717.93 g/mol, XLogP of 55.37, 22 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for bis(3,4-dimethylphenyl)methanone;1-(3,4-dimethylphenoxy)-2,3-dimethylbenzene;4-(3,4-dimethylphenoxy)-1,2-dimethylbenzene;1-[(3,4-dimethylphenyl)-difluoromethyl]-2,3-dimethylbenzene;4-[(3,4-dimethylphenyl)-difluoromethyl]-1,2-dimethylbenzene;1-[(3,4-dimethylphenyl)methyl]-2,3-dimethylbenzene;4-[(3,4-dimethylphenyl)methyl]-1,2-dimethylbenzene;4-[4-(3,4-dimethylphenyl)phenyl]-1,2-dimethylbenzene;1-(3,4-dimethylphenyl)sulfanyl-2,3-dimethylbenzene;4-(3,4-dimethylphenyl)sulfanyl-1,2-dimethylbenzene;1,2,4,5-tetramethyl-3,6-diphenylbenzene is sourced from PubChem (CID 158330322), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).