bis(4-methylphenyl)methanone;3,3-dimethylpentane;1-[1,1,1,3,3,3-hexafluoro-2-(4-methylphenyl)propan-2-yl]-4-methylbenzene;methane;1-methyl-4-(4-methylphenoxy)benzene;1-methyl-4-(4-methylphenyl)benzene;1-methyl-4-[(4-methylphenyl)methyl]benzene;1-methyl-4-[2-(4-methylphenyl)propan-2-yl]benzene;1-methyl-4-(4-methylphenyl)sulfanylbenzene;1,1,3,5,6-pentamethyl-3-(4-methylphenyl)-2H-indene;propane;1,3-xylene;1,4-xylene

C160H200F6O2S — CID 158006312

IUPACbis(4-methylphenyl)methanone;3,3-dimethylpentane;1-[1,1,1,3,3,3-hexafluoro-2-(4-methylphenyl)propan-2-yl]-4-methylbenzene;methane;1-methyl-4-(4-methylphenoxy)benzene;1-methyl-4-(4-methylphenyl)benzene;1-methyl-4-[(4-methylphenyl)methyl]benzene;1-methyl-4-[2-(4-methylphenyl)propan-2-yl]benzene;1-methyl-4-(4-methylphenyl)sulfanylbenzene;1,1,3,5,6-pentamethyl-3-(4-methylphenyl)-2H-indene;propane;1,3-xylene;1,4-xylene
SMILESC.C.C.C.CCC.CCC.CCC(C)(C)CC.Cc1ccc(-c2ccc(C)cc2)cc1.Cc1ccc(C(=O)c2ccc(C)cc2)cc1.Cc1ccc(C(C)(C)c2ccc(C)cc2)cc1.Cc1ccc(C(c2ccc(C)cc2)(C(F)(F)F)C(F)(F)F)cc1.Cc1ccc(C)cc1.Cc1ccc(C2(C)CC(C)(C)c3cc(C)c(C)cc32)cc1.Cc1ccc(Cc2ccc(C)cc2)cc1.Cc1ccc(Oc2ccc(C)cc2)cc1.Cc1ccc(Sc2ccc(C)cc2)cc1.Cc1cccc(C)c1
InChIInChI=1S/C21H26.C17H14F6.C17H20.C15H14O.C15H16.C14H14O.C14H14S.C14H14.2C8H10.C7H16.2C3H8.4CH4/c1-14-7-9-17(10-8-14)21(6)13-20(4,5)18-11-15(2)16(3)12-19(18)21;1-11-3-7-13(8-4-11)15(16(18,19)20,17(21,22)23)14-9-5-12(2)6-10-14;1-13-5-9-15(10-6-13)17(3,4)16-11-7-14(2)8-12-16;1-11-3-7-13(8-4-11)15(16)14-9-5-12(2)6-10-14;1-12-3-7-14(8-4-12)11-15-9-5-13(2)6-10-15;2*1-11-3-7-13(8-4-11)15-14-9-5-12(2)6-10-14;1-11-3-7-13(8-4-11)14-9-5-12(2)6-10-14;1-7-3-5-8(2)6-4-7;1-7-4-3-5-8(2)6-7;1-5-7(3,4)6-2;2*1-3-2;;;;/h7-12H,13H2,1-6H3;3-10H,1-2H3;5-12H,1-4H3;3-10H,1-2H3;3-10H,11H2,1-2H3;2*3-10H,1-2H3;3-10H,1-2H3;2*3-6H,1-2H3;5-6H2,1-4H3;2*3H2,1-2H3;4*1H4
InChIKeyFEIIKIYSJLSVKC-UHFFFAOYSA-N
MW2301.41 g/mol
LogP48.71
Rot. Bonds16

About bis(4-methylphenyl)methanone;3,3-dimethylpentane;1-[1,1,1,3,3,3-hexafluoro-2-(4-methylphenyl)propan-2-yl]-4-methylbenzene;methane;1-methyl-4-(4-methylphenoxy)benzene;1-methyl-4-(4-methylphenyl)benzene;1-methyl-4-[(4-methylphenyl)methyl]benzene;1-methyl-4-[2-(4-methylphenyl)propan-2-yl]benzene;1-methyl-4-(4-methylphenyl)sulfanylbenzene;1,1,3,5,6-pentamethyl-3-(4-methylphenyl)-2H-indene;propane;1,3-xylene;1,4-xylene

bis(4-methylphenyl)methanone;3,3-dimethylpentane;1-[1,1,1,3,3,3-hexafluoro-2-(4-methylphenyl)propan-2-yl]-4-methylbenzene;methane;1-methyl-4-(4-methylphenoxy)benzene;1-methyl-4-(4-methylphenyl)benzene;1-methyl-4-[(4-methylphenyl)methyl]benzene;1-methyl-4-[2-(4-methylphenyl)propan-2-yl]benzene;1-methyl-4-(4-methylphenyl)sulfanylbenzene;1,1,3,5,6-pentamethyl-3-(4-methylphenyl)-2H-indene;propane;1,3-xylene;1,4-xylene (PubChem CID 158006312) has the molecular formula C160H200F6O2S and a molecular weight of 2301.41 g/mol. Its IUPAC name is bis(4-methylphenyl)methanone;3,3-dimethylpentane;1-[1,1,1,3,3,3-hexafluoro-2-(4-methylphenyl)propan-2-yl]-4-methylbenzene;methane;1-methyl-4-(4-methylphenoxy)benzene;1-methyl-4-(4-methylphenyl)benzene;1-methyl-4-[(4-methylphenyl)methyl]benzene;1-methyl-4-[2-(4-methylphenyl)propan-2-yl]benzene;1-methyl-4-(4-methylphenyl)sulfanylbenzene;1,1,3,5,6-pentamethyl-3-(4-methylphenyl)-2H-indene;propane;1,3-xylene;1,4-xylene.

Molecular Properties

Compound Namebis(4-methylphenyl)methanone;3,3-dimethylpentane;1-[1,1,1,3,3,3-hexafluoro-2-(4-methylphenyl)propan-2-yl]-4-methylbenzene;methane;1-methyl-4-(4-methylphenoxy)benzene;1-methyl-4-(4-methylphenyl)benzene;1-methyl-4-[(4-methylphenyl)methyl]benzene;1-methyl-4-[2-(4-methylphenyl)propan-2-yl]benzene;1-methyl-4-(4-methylphenyl)sulfanylbenzene;1,1,3,5,6-pentamethyl-3-(4-methylphenyl)-2H-indene;propane;1,3-xylene;1,4-xylene
PubChem CID158006312
Molecular FormulaC160H200F6O2S
Molecular Weight2301.41 g/mol
Exact Mass2299.52
IUPAC Namebis(4-methylphenyl)methanone;3,3-dimethylpentane;1-[1,1,1,3,3,3-hexafluoro-2-(4-methylphenyl)propan-2-yl]-4-methylbenzene;methane;1-methyl-4-(4-methylphenoxy)benzene;1-methyl-4-(4-methylphenyl)benzene;1-methyl-4-[(4-methylphenyl)methyl]benzene;1-methyl-4-[2-(4-methylphenyl)propan-2-yl]benzene;1-methyl-4-(4-methylphenyl)sulfanylbenzene;1,1,3,5,6-pentamethyl-3-(4-methylphenyl)-2H-indene;propane;1,3-xylene;1,4-xylene
SMILESC.C.C.C.CCC.CCC.CCC(C)(C)CC.Cc1ccc(-c2ccc(C)cc2)cc1.Cc1ccc(C(=O)c2ccc(C)cc2)cc1.Cc1ccc(C(C)(C)c2ccc(C)cc2)cc1.Cc1ccc(C(c2ccc(C)cc2)(C(F)(F)F)C(F)(F)F)cc1.Cc1ccc(C)cc1.Cc1ccc(C2(C)CC(C)(C)c3cc(C)c(C)cc32)cc1.Cc1ccc(Cc2ccc(C)cc2)cc1.Cc1ccc(Oc2ccc(C)cc2)cc1.Cc1ccc(Sc2ccc(C)cc2)cc1.Cc1cccc(C)c1
InChIInChI=1S/C21H26.C17H14F6.C17H20.C15H14O.C15H16.C14H14O.C14H14S.C14H14.2C8H10.C7H16.2C3H8.4CH4/c1-14-7-9-17(10-8-14)21(6)13-20(4,5)18-11-15(2)16(3)12-19(18)21;1-11-3-7-13(8-4-11)15(16(18,19)20,17(21,22)23)14-9-5-12(2)6-10-14;1-13-5-9-15(10-6-13)17(3,4)16-11-7-14(2)8-12-16;1-11-3-7-13(8-4-11)15(16)14-9-5-12(2)6-10-14;1-12-3-7-14(8-4-12)11-15-9-5-13(2)6-10-15;2*1-11-3-7-13(8-4-11)15-14-9-5-12(2)6-10-14;1-11-3-7-13(8-4-11)14-9-5-12(2)6-10-14;1-7-3-5-8(2)6-4-7;1-7-4-3-5-8(2)6-7;1-5-7(3,4)6-2;2*1-3-2;;;;/h7-12H,13H2,1-6H3;3-10H,1-2H3;5-12H,1-4H3;3-10H,1-2H3;3-10H,11H2,1-2H3;2*3-10H,1-2H3;3-10H,1-2H3;2*3-6H,1-2H3;5-6H2,1-4H3;2*3H2,1-2H3;4*1H4
InChIKeyFEIIKIYSJLSVKC-UHFFFAOYSA-N
XLogP48.71
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds16
Heavy Atoms169
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002301.41
LogP ≤ 548.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze bis(4-methylphenyl)methanone;3,3-dimethylpentane;1-[1,1,1,3,3,3-hexafluoro-2-(4-methylphenyl)propan-2-yl]-4-methylbenzene;methane;1-methyl-4-(4-methylphenoxy)benzene;1-methyl-4-(4-methylphenyl)benzene;1-methyl-4-[(4-methylphenyl)methyl]benzene;1-methyl-4-[2-(4-methylphenyl)propan-2-yl]benzene;1-methyl-4-(4-methylphenyl)sulfanylbenzene;1,1,3,5,6-pentamethyl-3-(4-methylphenyl)-2H-indene;propane;1,3-xylene;1,4-xylene with MolForge

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Related Compounds

5-(4-Methoxyphenyl)-1-[7-[5-(4-methoxyphenyl)penta-2,4-dienoyl]-9,9-bis[4-(1,2,2-trifluoroethenoxy)phenyl]fluoren-2-yl]penta-2,4-dien-1-one
CID 53634050
1-[9,9-Bis[4-(1,2,2-trifluoroethenoxy)phenyl]fluoren-2-yl]-3-(4-methoxyphenyl)prop-2-en-1-one
CID 53660156
1-[9,9-Bis[4-(1,2,2-trifluoroethenoxy)phenyl]fluoren-2-yl]-5-(4-methoxyphenyl)penta-2,4-dien-1-one
CID 53973178
1-[9,9-Bis[4-(1,2,2-trifluoroethenoxy)phenyl]fluoren-2-yl]-3-(2-methoxyphenyl)prop-2-en-1-one
CID 54203395
1-[9,9-Bis[4-(1,2,2-trifluoroethenoxy)phenyl]fluoren-2-yl]-5-phenylpenta-2,4-dien-1-one
CID 54232930
3-(4-Methoxyphenyl)-1-[7-[3-(4-methoxyphenyl)prop-2-enoyl]-9,9-bis[4-(1,2,2-trifluoroethenoxy)phenyl]fluoren-2-yl]prop-2-en-1-one
CID 54247547
3-Phenyl-1-[7-(3-phenylprop-2-enoyl)-9,9-bis[4-(1,2,2-trifluoroethenoxy)phenyl]fluoren-2-yl]prop-2-en-1-one
CID 54439374
1-[9,9-Bis[4-(1,2,2-trifluoroethenoxy)phenyl]fluoren-2-yl]-5-(2-methoxyphenyl)penta-2,4-dien-1-one
CID 54440553
5-Phenyl-1-[7-(5-phenylpenta-2,4-dienoyl)-9,9-bis[4-(1,2,2-trifluoroethenoxy)phenyl]fluoren-2-yl]penta-2,4-dien-1-one
CID 54445573
3-(2-Methoxyphenyl)-1-[7-[3-(2-methoxyphenyl)prop-2-enoyl]-9,9-bis[4-(1,2,2-trifluoroethenoxy)phenyl]fluoren-2-yl]prop-2-en-1-one
CID 54459614
1-[9,9-Bis[4-(1,2,2-trifluoroethenoxy)phenyl]fluoren-2-yl]-3-phenylprop-2-en-1-one
CID 54486597
[4-[4-[1,1,1,3,3,3-Hexafluoro-2-[4-[4-(4-methylphenyl)sulfonylphenoxy]phenyl]propan-2-yl]phenoxy]phenyl]-(4-methylphenyl)methanone
CID 57737974

Frequently Asked Questions

What is the IUPAC name of bis(4-methylphenyl)methanone;3,3-dimethylpentane;1-[1,1,1,3,3,3-hexafluoro-2-(4-methylphenyl)propan-2-yl]-4-methylbenzene;methane;1-methyl-4-(4-methylphenoxy)benzene;1-methyl-4-(4-methylphenyl)benzene;1-methyl-4-[(4-methylphenyl)methyl]benzene;1-methyl-4-[2-(4-methylphenyl)propan-2-yl]benzene;1-methyl-4-(4-methylphenyl)sulfanylbenzene;1,1,3,5,6-pentamethyl-3-(4-methylphenyl)-2H-indene;propane;1,3-xylene;1,4-xylene?
The IUPAC name of bis(4-methylphenyl)methanone;3,3-dimethylpentane;1-[1,1,1,3,3,3-hexafluoro-2-(4-methylphenyl)propan-2-yl]-4-methylbenzene;methane;1-methyl-4-(4-methylphenoxy)benzene;1-methyl-4-(4-methylphenyl)benzene;1-methyl-4-[(4-methylphenyl)methyl]benzene;1-methyl-4-[2-(4-methylphenyl)propan-2-yl]benzene;1-methyl-4-(4-methylphenyl)sulfanylbenzene;1,1,3,5,6-pentamethyl-3-(4-methylphenyl)-2H-indene;propane;1,3-xylene;1,4-xylene (CID 158006312) is bis(4-methylphenyl)methanone;3,3-dimethylpentane;1-[1,1,1,3,3,3-hexafluoro-2-(4-methylphenyl)propan-2-yl]-4-methylbenzene;methane;1-methyl-4-(4-methylphenoxy)benzene;1-methyl-4-(4-methylphenyl)benzene;1-methyl-4-[(4-methylphenyl)methyl]benzene;1-methyl-4-[2-(4-methylphenyl)propan-2-yl]benzene;1-methyl-4-(4-methylphenyl)sulfanylbenzene;1,1,3,5,6-pentamethyl-3-(4-methylphenyl)-2H-indene;propane;1,3-xylene;1,4-xylene.
What is the SMILES notation for bis(4-methylphenyl)methanone;3,3-dimethylpentane;1-[1,1,1,3,3,3-hexafluoro-2-(4-methylphenyl)propan-2-yl]-4-methylbenzene;methane;1-methyl-4-(4-methylphenoxy)benzene;1-methyl-4-(4-methylphenyl)benzene;1-methyl-4-[(4-methylphenyl)methyl]benzene;1-methyl-4-[2-(4-methylphenyl)propan-2-yl]benzene;1-methyl-4-(4-methylphenyl)sulfanylbenzene;1,1,3,5,6-pentamethyl-3-(4-methylphenyl)-2H-indene;propane;1,3-xylene;1,4-xylene?
The canonical SMILES for bis(4-methylphenyl)methanone;3,3-dimethylpentane;1-[1,1,1,3,3,3-hexafluoro-2-(4-methylphenyl)propan-2-yl]-4-methylbenzene;methane;1-methyl-4-(4-methylphenoxy)benzene;1-methyl-4-(4-methylphenyl)benzene;1-methyl-4-[(4-methylphenyl)methyl]benzene;1-methyl-4-[2-(4-methylphenyl)propan-2-yl]benzene;1-methyl-4-(4-methylphenyl)sulfanylbenzene;1,1,3,5,6-pentamethyl-3-(4-methylphenyl)-2H-indene;propane;1,3-xylene;1,4-xylene is C.C.C.C.CCC.CCC.CCC(C)(C)CC.Cc1ccc(-c2ccc(C)cc2)cc1.Cc1ccc(C(=O)c2ccc(C)cc2)cc1.Cc1ccc(C(C)(C)c2ccc(C)cc2)cc1.Cc1ccc(C(c2ccc(C)cc2)(C(F)(F)F)C(F)(F)F)cc1.Cc1ccc(C)cc1.Cc1ccc(C2(C)CC(C)(C)c3cc(C)c(C)cc32)cc1.Cc1ccc(Cc2ccc(C)cc2)cc1.Cc1ccc(Oc2ccc(C)cc2)cc1.Cc1ccc(Sc2ccc(C)cc2)cc1.Cc1cccc(C)c1.
What is the InChIKey of bis(4-methylphenyl)methanone;3,3-dimethylpentane;1-[1,1,1,3,3,3-hexafluoro-2-(4-methylphenyl)propan-2-yl]-4-methylbenzene;methane;1-methyl-4-(4-methylphenoxy)benzene;1-methyl-4-(4-methylphenyl)benzene;1-methyl-4-[(4-methylphenyl)methyl]benzene;1-methyl-4-[2-(4-methylphenyl)propan-2-yl]benzene;1-methyl-4-(4-methylphenyl)sulfanylbenzene;1,1,3,5,6-pentamethyl-3-(4-methylphenyl)-2H-indene;propane;1,3-xylene;1,4-xylene?
The InChIKey is FEIIKIYSJLSVKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H26.C17H14F6.C17H20.C15H14O.C15H16.C14H14O.C14H14S.C14H14.2C8H10.C7H16.2C3H8.4CH4/c1-14-7-9-17(10-8-14)21(6)13-20(4,5)18-11-15(2)16(3)12-19(18)21;1-11-3-7-13(8-4-11)15(16(18,19)20,17(21,22)23)14-9-5-12(2)6-10-14;1-13-5-9-15(10-6-13)17(3,4)16-11-7-14(2)8-12-16;1-11-3-7-13(8-4-11)15(16)14-9-5-12(2)6-10-14;1-12-3-7-14(8-4-12)11-15-9-5-13(2)6-10-15;2*1-11-3-7-13(8-4-11)15-14-9-5-12(2)6-10-14;1-11-3-7-13(8-4-11)14-9-5-12(2)6-10-14;1-7-3-5-8(2)6-4-7;1-7-4-3-5-8(2)6-7;1-5-7(3,4)6-2;2*1-3-2;;;;/h7-12H,13H2,1-6H3;3-10H,1-2H3;5-12H,1-4H3;3-10H,1-2H3;3-10H,11H2,1-2H3;2*3-10H,1-2H3;3-10H,1-2H3;2*3-6H,1-2H3;5-6H2,1-4H3;2*3H2,1-2H3;4*1H4.
What are the key properties of bis(4-methylphenyl)methanone;3,3-dimethylpentane;1-[1,1,1,3,3,3-hexafluoro-2-(4-methylphenyl)propan-2-yl]-4-methylbenzene;methane;1-methyl-4-(4-methylphenoxy)benzene;1-methyl-4-(4-methylphenyl)benzene;1-methyl-4-[(4-methylphenyl)methyl]benzene;1-methyl-4-[2-(4-methylphenyl)propan-2-yl]benzene;1-methyl-4-(4-methylphenyl)sulfanylbenzene;1,1,3,5,6-pentamethyl-3-(4-methylphenyl)-2H-indene;propane;1,3-xylene;1,4-xylene?
bis(4-methylphenyl)methanone;3,3-dimethylpentane;1-[1,1,1,3,3,3-hexafluoro-2-(4-methylphenyl)propan-2-yl]-4-methylbenzene;methane;1-methyl-4-(4-methylphenoxy)benzene;1-methyl-4-(4-methylphenyl)benzene;1-methyl-4-[(4-methylphenyl)methyl]benzene;1-methyl-4-[2-(4-methylphenyl)propan-2-yl]benzene;1-methyl-4-(4-methylphenyl)sulfanylbenzene;1,1,3,5,6-pentamethyl-3-(4-methylphenyl)-2H-indene;propane;1,3-xylene;1,4-xylene has a molecular weight of 2301.41 g/mol, XLogP of 48.71, 16 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for bis(4-methylphenyl)methanone;3,3-dimethylpentane;1-[1,1,1,3,3,3-hexafluoro-2-(4-methylphenyl)propan-2-yl]-4-methylbenzene;methane;1-methyl-4-(4-methylphenoxy)benzene;1-methyl-4-(4-methylphenyl)benzene;1-methyl-4-[(4-methylphenyl)methyl]benzene;1-methyl-4-[2-(4-methylphenyl)propan-2-yl]benzene;1-methyl-4-(4-methylphenyl)sulfanylbenzene;1,1,3,5,6-pentamethyl-3-(4-methylphenyl)-2H-indene;propane;1,3-xylene;1,4-xylene is sourced from PubChem (CID 158006312), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).