bis(3,4-dimethylphenyl)methanone;4-(3,4-dimethylphenoxy)-1,2-dimethylbenzene;4-[4-(3,4-dimethylphenoxy)phenoxy]-1,2-dimethylbenzene;4-[4-[4-(3,4-dimethylphenoxy)phenyl]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-[4-(3,4-dimethylphenyl)phenyl]-1,2-dimethylbenzene;4-[4-[4-(3,4-dimethylphenyl)phenyl]phenyl]-1,2-dimethylbenzene;4-(3,4-dimethylphenyl)sulfonyl-1,2-dimethylbenzene;3,4,9,10-tetramethyl-3a,12c-dihydroperylene;1,2,4,5-tetramethylbenzene;1,2,5,6-tetramethylnaphthalene;2,3,6,7-tetramethylnaphthalene

C246H254F6O8S — CID 157335764

IUPACbis(3,4-dimethylphenyl)methanone;4-(3,4-dimethylphenoxy)-1,2-dimethylbenzene;4-[4-(3,4-dimethylphenoxy)phenoxy]-1,2-dimethylbenzene;4-[4-[4-(3,4-dimethylphenoxy)phenyl]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-[4-(3,4-dimethylphenyl)phenyl]-1,2-dimethylbenzene;4-[4-[4-(3,4-dimethylphenyl)phenyl]phenyl]-1,2-dimethylbenzene;4-(3,4-dimethylphenyl)sulfonyl-1,2-dimethylbenzene;3,4,9,10-tetramethyl-3a,12c-dihydroperylene;1,2,4,5-tetramethylbenzene;1,2,5,6-tetramethylnaphthalene;2,3,6,7-tetramethylnaphthalene
SMILESCC1=CC=C2c3ccc(C)c4c(C)ccc(c34)C3=CC=C(C)C1C23.Cc1cc(C)c(C)cc1C.Cc1cc2cc(C)c(C)cc2cc1C.Cc1ccc(-c2ccc(-c3ccc(-c4ccc(C)c(C)c4)cc3)cc2)cc1C.Cc1ccc(-c2ccc(-c3ccc(C)c(C)c3)cc2)cc1C.Cc1ccc(-c2ccc(C)c(C)c2)cc1C.Cc1ccc(C(=O)c2ccc(C)c(C)c2)cc1C.Cc1ccc(C(c2ccc(C)c(C)c2)(C(F)(F)F)C(F)(F)F)cc1C.Cc1ccc(Oc2ccc(-c3ccc(Oc4ccc(C)c(C)c4)cc3)cc2)cc1C.Cc1ccc(Oc2ccc(C)c(C)c2)cc1C.Cc1ccc(Oc2ccc(Oc3ccc(C)c(C)c3)cc2)cc1C.Cc1ccc(S(=O)(=O)c2ccc(C)c(C)c2)cc1C.Cc1ccc2c(C)c(C)ccc2c1C
InChIInChI=1S/C28H26O2.C28H26.C24H22.C22H22O2.C22H22.C19H18F6.C17H18O.C16H18O2S.C16H18O.C16H18.2C14H16.C10H14/c1-19-5-11-27(17-21(19)3)29-25-13-7-23(8-14-25)24-9-15-26(16-10-24)30-28-12-6-20(2)22(4)18-28;1-19-5-7-27(17-21(19)3)25-13-9-23(10-14-25)24-11-15-26(16-12-24)28-8-6-20(2)22(4)18-28;1-13-5-9-17-19-11-7-15(3)22-16(4)8-12-20(24(19)22)18-10-6-14(2)21(13)23(17)18;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;1-15-5-7-21(13-17(15)3)19-9-11-20(12-10-19)22-8-6-16(2)18(4)14-22;1-11-5-7-15(9-13(11)3)17(18(20,21)22,19(23,24)25)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;1-11-5-7-15(9-13(11)3)19(17,18)16-8-6-12(2)14(4)10-16;1-11-5-7-15(9-13(11)3)17-16-8-6-12(2)14(4)10-16;1-11-5-7-15(9-13(11)3)16-8-6-12(2)14(4)10-16;1-9-5-13-7-11(3)12(4)8-14(13)6-10(9)2;1-9-5-7-14-12(4)10(2)6-8-13(14)11(9)3;1-7-5-9(3)10(4)6-8(7)2/h5-18H,1-4H3;5-18H,1-4H3;5-12,21,23H,1-4H3;5-14H,1-4H3;5-14H,1-4H3;5-10H,1-4H3;5-10H,1-4H3;5-10H,1-4H3;5-10H,1-4H3;5-10H,1-4H3;2*5-8H,1-4H3;5-6H,1-4H3
InChIKeyBFUZKCGUFYPCEO-UHFFFAOYSA-N
MW3484.78 g/mol
LogP69.84
Rot. Bonds23

About bis(3,4-dimethylphenyl)methanone;4-(3,4-dimethylphenoxy)-1,2-dimethylbenzene;4-[4-(3,4-dimethylphenoxy)phenoxy]-1,2-dimethylbenzene;4-[4-[4-(3,4-dimethylphenoxy)phenyl]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-[4-(3,4-dimethylphenyl)phenyl]-1,2-dimethylbenzene;4-[4-[4-(3,4-dimethylphenyl)phenyl]phenyl]-1,2-dimethylbenzene;4-(3,4-dimethylphenyl)sulfonyl-1,2-dimethylbenzene;3,4,9,10-tetramethyl-3a,12c-dihydroperylene;1,2,4,5-tetramethylbenzene;1,2,5,6-tetramethylnaphthalene;2,3,6,7-tetramethylnaphthalene

bis(3,4-dimethylphenyl)methanone;4-(3,4-dimethylphenoxy)-1,2-dimethylbenzene;4-[4-(3,4-dimethylphenoxy)phenoxy]-1,2-dimethylbenzene;4-[4-[4-(3,4-dimethylphenoxy)phenyl]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-[4-(3,4-dimethylphenyl)phenyl]-1,2-dimethylbenzene;4-[4-[4-(3,4-dimethylphenyl)phenyl]phenyl]-1,2-dimethylbenzene;4-(3,4-dimethylphenyl)sulfonyl-1,2-dimethylbenzene;3,4,9,10-tetramethyl-3a,12c-dihydroperylene;1,2,4,5-tetramethylbenzene;1,2,5,6-tetramethylnaphthalene;2,3,6,7-tetramethylnaphthalene (PubChem CID 157335764) has the molecular formula C246H254F6O8S and a molecular weight of 3484.78 g/mol. Its IUPAC name is bis(3,4-dimethylphenyl)methanone;4-(3,4-dimethylphenoxy)-1,2-dimethylbenzene;4-[4-(3,4-dimethylphenoxy)phenoxy]-1,2-dimethylbenzene;4-[4-[4-(3,4-dimethylphenoxy)phenyl]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-[4-(3,4-dimethylphenyl)phenyl]-1,2-dimethylbenzene;4-[4-[4-(3,4-dimethylphenyl)phenyl]phenyl]-1,2-dimethylbenzene;4-(3,4-dimethylphenyl)sulfonyl-1,2-dimethylbenzene;3,4,9,10-tetramethyl-3a,12c-dihydroperylene;1,2,4,5-tetramethylbenzene;1,2,5,6-tetramethylnaphthalene;2,3,6,7-tetramethylnaphthalene.

Molecular Properties

Compound Namebis(3,4-dimethylphenyl)methanone;4-(3,4-dimethylphenoxy)-1,2-dimethylbenzene;4-[4-(3,4-dimethylphenoxy)phenoxy]-1,2-dimethylbenzene;4-[4-[4-(3,4-dimethylphenoxy)phenyl]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-[4-(3,4-dimethylphenyl)phenyl]-1,2-dimethylbenzene;4-[4-[4-(3,4-dimethylphenyl)phenyl]phenyl]-1,2-dimethylbenzene;4-(3,4-dimethylphenyl)sulfonyl-1,2-dimethylbenzene;3,4,9,10-tetramethyl-3a,12c-dihydroperylene;1,2,4,5-tetramethylbenzene;1,2,5,6-tetramethylnaphthalene;2,3,6,7-tetramethylnaphthalene
PubChem CID157335764
Molecular FormulaC246H254F6O8S
Molecular Weight3484.78 g/mol
Exact Mass3481.91
IUPAC Namebis(3,4-dimethylphenyl)methanone;4-(3,4-dimethylphenoxy)-1,2-dimethylbenzene;4-[4-(3,4-dimethylphenoxy)phenoxy]-1,2-dimethylbenzene;4-[4-[4-(3,4-dimethylphenoxy)phenyl]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-[4-(3,4-dimethylphenyl)phenyl]-1,2-dimethylbenzene;4-[4-[4-(3,4-dimethylphenyl)phenyl]phenyl]-1,2-dimethylbenzene;4-(3,4-dimethylphenyl)sulfonyl-1,2-dimethylbenzene;3,4,9,10-tetramethyl-3a,12c-dihydroperylene;1,2,4,5-tetramethylbenzene;1,2,5,6-tetramethylnaphthalene;2,3,6,7-tetramethylnaphthalene
SMILESCC1=CC=C2c3ccc(C)c4c(C)ccc(c34)C3=CC=C(C)C1C23.Cc1cc(C)c(C)cc1C.Cc1cc2cc(C)c(C)cc2cc1C.Cc1ccc(-c2ccc(-c3ccc(-c4ccc(C)c(C)c4)cc3)cc2)cc1C.Cc1ccc(-c2ccc(-c3ccc(C)c(C)c3)cc2)cc1C.Cc1ccc(-c2ccc(C)c(C)c2)cc1C.Cc1ccc(C(=O)c2ccc(C)c(C)c2)cc1C.Cc1ccc(C(c2ccc(C)c(C)c2)(C(F)(F)F)C(F)(F)F)cc1C.Cc1ccc(Oc2ccc(-c3ccc(Oc4ccc(C)c(C)c4)cc3)cc2)cc1C.Cc1ccc(Oc2ccc(C)c(C)c2)cc1C.Cc1ccc(Oc2ccc(Oc3ccc(C)c(C)c3)cc2)cc1C.Cc1ccc(S(=O)(=O)c2ccc(C)c(C)c2)cc1C.Cc1ccc2c(C)c(C)ccc2c1C
InChIInChI=1S/C28H26O2.C28H26.C24H22.C22H22O2.C22H22.C19H18F6.C17H18O.C16H18O2S.C16H18O.C16H18.2C14H16.C10H14/c1-19-5-11-27(17-21(19)3)29-25-13-7-23(8-14-25)24-9-15-26(16-10-24)30-28-12-6-20(2)22(4)18-28;1-19-5-7-27(17-21(19)3)25-13-9-23(10-14-25)24-11-15-26(16-12-24)28-8-6-20(2)22(4)18-28;1-13-5-9-17-19-11-7-15(3)22-16(4)8-12-20(24(19)22)18-10-6-14(2)21(13)23(17)18;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;1-15-5-7-21(13-17(15)3)19-9-11-20(12-10-19)22-8-6-16(2)18(4)14-22;1-11-5-7-15(9-13(11)3)17(18(20,21)22,19(23,24)25)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;1-11-5-7-15(9-13(11)3)19(17,18)16-8-6-12(2)14(4)10-16;1-11-5-7-15(9-13(11)3)17-16-8-6-12(2)14(4)10-16;1-11-5-7-15(9-13(11)3)16-8-6-12(2)14(4)10-16;1-9-5-13-7-11(3)12(4)8-14(13)6-10(9)2;1-9-5-7-14-12(4)10(2)6-8-13(14)11(9)3;1-7-5-9(3)10(4)6-8(7)2/h5-18H,1-4H3;5-18H,1-4H3;5-12,21,23H,1-4H3;5-14H,1-4H3;5-14H,1-4H3;5-10H,1-4H3;5-10H,1-4H3;5-10H,1-4H3;5-10H,1-4H3;5-10H,1-4H3;2*5-8H,1-4H3;5-6H,1-4H3
InChIKeyBFUZKCGUFYPCEO-UHFFFAOYSA-N
XLogP69.84
TPSA97.36 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds23
Heavy Atoms261
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5003484.78
LogP ≤ 569.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Analyze bis(3,4-dimethylphenyl)methanone;4-(3,4-dimethylphenoxy)-1,2-dimethylbenzene;4-[4-(3,4-dimethylphenoxy)phenoxy]-1,2-dimethylbenzene;4-[4-[4-(3,4-dimethylphenoxy)phenyl]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-[4-(3,4-dimethylphenyl)phenyl]-1,2-dimethylbenzene;4-[4-[4-(3,4-dimethylphenyl)phenyl]phenyl]-1,2-dimethylbenzene;4-(3,4-dimethylphenyl)sulfonyl-1,2-dimethylbenzene;3,4,9,10-tetramethyl-3a,12c-dihydroperylene;1,2,4,5-tetramethylbenzene;1,2,5,6-tetramethylnaphthalene;2,3,6,7-tetramethylnaphthalene with MolForge

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Related Compounds

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CID 163297716
[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
4-[5-Methoxy-2-[4-[4-[4-[4-(4-methylbenzoyl)phenoxy]-3-[3-methyl-5-(trifluoromethyl)phenyl]phenoxy]benzoyl]phenoxy]phenyl]-2-methylbenzenesulfonic acid
CID 57822735
4-[2-[4-[4-[4-[1,1,1,3,3,3-Hexafluoro-2-[4-[4-(4-methylbenzoyl)phenoxy]phenyl]propan-2-yl]phenoxy]benzoyl]phenoxy]-5-methoxyphenyl]benzenesulfonic acid
CID 57822743
[4-[4-[1,1,1,3,3,3-Hexafluoro-2-[4-[4-[4-[4-methyl-3-[3-(trioxidanylsulfanyl)phenyl]sulfonylphenyl]benzoyl]phenoxy]phenyl]propan-2-yl]phenoxy]phenyl]-(4-methylphenyl)methanone
CID 58658211
[4-[4-[1,1,1,3,3,3-Hexafluoro-2-[4-[4-[4-[4-methyl-3-(4-sulfanylbenzoyl)phenyl]benzoyl]phenoxy]phenyl]propan-2-yl]phenoxy]phenyl]-(4-methylphenyl)methanone
CID 58693255
[4-[4-[1,1,1,3,3,3-Hexafluoro-2-[4-[4-[4-[4-methyl-3-[4-(oxan-2-ylsulfanyl)benzoyl]phenyl]benzoyl]phenoxy]phenyl]propan-2-yl]phenoxy]phenyl]-(4-methylphenyl)methanone
CID 58693258
3-[4-[5-[4-[4-[4-[1,1,1,3,3,3-Hexafluoro-2-[4-[4-(4-methylbenzoyl)phenoxy]phenyl]propan-2-yl]phenoxy]benzoyl]phenyl]-2-methylbenzoyl]phenyl]sulfanylpropane-1-sulfonic acid
CID 58693264
CID 58693268
CID 58693268
[4-[4-[1,1,1,3,3,3-Hexafluoro-2-[4-[4-[4-[4-[4-[1,1,1,3,3,3-hexafluoro-2-[4-[4-[4-[4-methyl-3-[3-(trioxidanylsulfanyl)benzoyl]phenyl]benzoyl]phenoxy]phenyl]propan-2-yl]phenoxy]butyl]phenyl]sulfonylphenoxy]phenyl]propan-2-yl]phenoxy]phenyl]-(4-methylphenyl)methanone
CID 58769498
6-[4-[5-[4-[4-[4-[1,1,1,3,3,3-Hexafluoro-2-[4-[4-(4-methylbenzoyl)phenoxy]phenyl]propan-2-yl]phenoxy]benzoyl]phenyl]-2-methylbenzoyl]phenoxy]-4-(trioxidanylsulfanyl)naphthalene-2-sulfonic acid
CID 58769499
[4-[3-[3-(3,3-Dimethylbutyl)-4-[6-(3,3-dimethylbutyl)-8-(2,2-dimethylpropyl-dihydroxy-oxo-lambda6-sulfanyl)naphthalen-2-yl]oxybenzoyl]-4-[4-(4-fluorobenzoyl)phenyl]phenyl]phenyl]-(4-fluorophenyl)methanone
CID 58769591

Frequently Asked Questions

What is the IUPAC name of bis(3,4-dimethylphenyl)methanone;4-(3,4-dimethylphenoxy)-1,2-dimethylbenzene;4-[4-(3,4-dimethylphenoxy)phenoxy]-1,2-dimethylbenzene;4-[4-[4-(3,4-dimethylphenoxy)phenyl]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-[4-(3,4-dimethylphenyl)phenyl]-1,2-dimethylbenzene;4-[4-[4-(3,4-dimethylphenyl)phenyl]phenyl]-1,2-dimethylbenzene;4-(3,4-dimethylphenyl)sulfonyl-1,2-dimethylbenzene;3,4,9,10-tetramethyl-3a,12c-dihydroperylene;1,2,4,5-tetramethylbenzene;1,2,5,6-tetramethylnaphthalene;2,3,6,7-tetramethylnaphthalene?
The IUPAC name of bis(3,4-dimethylphenyl)methanone;4-(3,4-dimethylphenoxy)-1,2-dimethylbenzene;4-[4-(3,4-dimethylphenoxy)phenoxy]-1,2-dimethylbenzene;4-[4-[4-(3,4-dimethylphenoxy)phenyl]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-[4-(3,4-dimethylphenyl)phenyl]-1,2-dimethylbenzene;4-[4-[4-(3,4-dimethylphenyl)phenyl]phenyl]-1,2-dimethylbenzene;4-(3,4-dimethylphenyl)sulfonyl-1,2-dimethylbenzene;3,4,9,10-tetramethyl-3a,12c-dihydroperylene;1,2,4,5-tetramethylbenzene;1,2,5,6-tetramethylnaphthalene;2,3,6,7-tetramethylnaphthalene (CID 157335764) is bis(3,4-dimethylphenyl)methanone;4-(3,4-dimethylphenoxy)-1,2-dimethylbenzene;4-[4-(3,4-dimethylphenoxy)phenoxy]-1,2-dimethylbenzene;4-[4-[4-(3,4-dimethylphenoxy)phenyl]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-[4-(3,4-dimethylphenyl)phenyl]-1,2-dimethylbenzene;4-[4-[4-(3,4-dimethylphenyl)phenyl]phenyl]-1,2-dimethylbenzene;4-(3,4-dimethylphenyl)sulfonyl-1,2-dimethylbenzene;3,4,9,10-tetramethyl-3a,12c-dihydroperylene;1,2,4,5-tetramethylbenzene;1,2,5,6-tetramethylnaphthalene;2,3,6,7-tetramethylnaphthalene.
What is the SMILES notation for bis(3,4-dimethylphenyl)methanone;4-(3,4-dimethylphenoxy)-1,2-dimethylbenzene;4-[4-(3,4-dimethylphenoxy)phenoxy]-1,2-dimethylbenzene;4-[4-[4-(3,4-dimethylphenoxy)phenyl]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-[4-(3,4-dimethylphenyl)phenyl]-1,2-dimethylbenzene;4-[4-[4-(3,4-dimethylphenyl)phenyl]phenyl]-1,2-dimethylbenzene;4-(3,4-dimethylphenyl)sulfonyl-1,2-dimethylbenzene;3,4,9,10-tetramethyl-3a,12c-dihydroperylene;1,2,4,5-tetramethylbenzene;1,2,5,6-tetramethylnaphthalene;2,3,6,7-tetramethylnaphthalene?
The canonical SMILES for bis(3,4-dimethylphenyl)methanone;4-(3,4-dimethylphenoxy)-1,2-dimethylbenzene;4-[4-(3,4-dimethylphenoxy)phenoxy]-1,2-dimethylbenzene;4-[4-[4-(3,4-dimethylphenoxy)phenyl]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-[4-(3,4-dimethylphenyl)phenyl]-1,2-dimethylbenzene;4-[4-[4-(3,4-dimethylphenyl)phenyl]phenyl]-1,2-dimethylbenzene;4-(3,4-dimethylphenyl)sulfonyl-1,2-dimethylbenzene;3,4,9,10-tetramethyl-3a,12c-dihydroperylene;1,2,4,5-tetramethylbenzene;1,2,5,6-tetramethylnaphthalene;2,3,6,7-tetramethylnaphthalene is CC1=CC=C2c3ccc(C)c4c(C)ccc(c34)C3=CC=C(C)C1C23.Cc1cc(C)c(C)cc1C.Cc1cc2cc(C)c(C)cc2cc1C.Cc1ccc(-c2ccc(-c3ccc(-c4ccc(C)c(C)c4)cc3)cc2)cc1C.Cc1ccc(-c2ccc(-c3ccc(C)c(C)c3)cc2)cc1C.Cc1ccc(-c2ccc(C)c(C)c2)cc1C.Cc1ccc(C(=O)c2ccc(C)c(C)c2)cc1C.Cc1ccc(C(c2ccc(C)c(C)c2)(C(F)(F)F)C(F)(F)F)cc1C.Cc1ccc(Oc2ccc(-c3ccc(Oc4ccc(C)c(C)c4)cc3)cc2)cc1C.Cc1ccc(Oc2ccc(C)c(C)c2)cc1C.Cc1ccc(Oc2ccc(Oc3ccc(C)c(C)c3)cc2)cc1C.Cc1ccc(S(=O)(=O)c2ccc(C)c(C)c2)cc1C.Cc1ccc2c(C)c(C)ccc2c1C.
What is the InChIKey of bis(3,4-dimethylphenyl)methanone;4-(3,4-dimethylphenoxy)-1,2-dimethylbenzene;4-[4-(3,4-dimethylphenoxy)phenoxy]-1,2-dimethylbenzene;4-[4-[4-(3,4-dimethylphenoxy)phenyl]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-[4-(3,4-dimethylphenyl)phenyl]-1,2-dimethylbenzene;4-[4-[4-(3,4-dimethylphenyl)phenyl]phenyl]-1,2-dimethylbenzene;4-(3,4-dimethylphenyl)sulfonyl-1,2-dimethylbenzene;3,4,9,10-tetramethyl-3a,12c-dihydroperylene;1,2,4,5-tetramethylbenzene;1,2,5,6-tetramethylnaphthalene;2,3,6,7-tetramethylnaphthalene?
The InChIKey is BFUZKCGUFYPCEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H26O2.C28H26.C24H22.C22H22O2.C22H22.C19H18F6.C17H18O.C16H18O2S.C16H18O.C16H18.2C14H16.C10H14/c1-19-5-11-27(17-21(19)3)29-25-13-7-23(8-14-25)24-9-15-26(16-10-24)30-28-12-6-20(2)22(4)18-28;1-19-5-7-27(17-21(19)3)25-13-9-23(10-14-25)24-11-15-26(16-12-24)28-8-6-20(2)22(4)18-28;1-13-5-9-17-19-11-7-15(3)22-16(4)8-12-20(24(19)22)18-10-6-14(2)21(13)23(17)18;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;1-15-5-7-21(13-17(15)3)19-9-11-20(12-10-19)22-8-6-16(2)18(4)14-22;1-11-5-7-15(9-13(11)3)17(18(20,21)22,19(23,24)25)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;1-11-5-7-15(9-13(11)3)19(17,18)16-8-6-12(2)14(4)10-16;1-11-5-7-15(9-13(11)3)17-16-8-6-12(2)14(4)10-16;1-11-5-7-15(9-13(11)3)16-8-6-12(2)14(4)10-16;1-9-5-13-7-11(3)12(4)8-14(13)6-10(9)2;1-9-5-7-14-12(4)10(2)6-8-13(14)11(9)3;1-7-5-9(3)10(4)6-8(7)2/h5-18H,1-4H3;5-18H,1-4H3;5-12,21,23H,1-4H3;5-14H,1-4H3;5-14H,1-4H3;5-10H,1-4H3;5-10H,1-4H3;5-10H,1-4H3;5-10H,1-4H3;5-10H,1-4H3;2*5-8H,1-4H3;5-6H,1-4H3.
What are the key properties of bis(3,4-dimethylphenyl)methanone;4-(3,4-dimethylphenoxy)-1,2-dimethylbenzene;4-[4-(3,4-dimethylphenoxy)phenoxy]-1,2-dimethylbenzene;4-[4-[4-(3,4-dimethylphenoxy)phenyl]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-[4-(3,4-dimethylphenyl)phenyl]-1,2-dimethylbenzene;4-[4-[4-(3,4-dimethylphenyl)phenyl]phenyl]-1,2-dimethylbenzene;4-(3,4-dimethylphenyl)sulfonyl-1,2-dimethylbenzene;3,4,9,10-tetramethyl-3a,12c-dihydroperylene;1,2,4,5-tetramethylbenzene;1,2,5,6-tetramethylnaphthalene;2,3,6,7-tetramethylnaphthalene?
bis(3,4-dimethylphenyl)methanone;4-(3,4-dimethylphenoxy)-1,2-dimethylbenzene;4-[4-(3,4-dimethylphenoxy)phenoxy]-1,2-dimethylbenzene;4-[4-[4-(3,4-dimethylphenoxy)phenyl]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-[4-(3,4-dimethylphenyl)phenyl]-1,2-dimethylbenzene;4-[4-[4-(3,4-dimethylphenyl)phenyl]phenyl]-1,2-dimethylbenzene;4-(3,4-dimethylphenyl)sulfonyl-1,2-dimethylbenzene;3,4,9,10-tetramethyl-3a,12c-dihydroperylene;1,2,4,5-tetramethylbenzene;1,2,5,6-tetramethylnaphthalene;2,3,6,7-tetramethylnaphthalene has a molecular weight of 3484.78 g/mol, XLogP of 69.84, 23 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for bis(3,4-dimethylphenyl)methanone;4-(3,4-dimethylphenoxy)-1,2-dimethylbenzene;4-[4-(3,4-dimethylphenoxy)phenoxy]-1,2-dimethylbenzene;4-[4-[4-(3,4-dimethylphenoxy)phenyl]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-[4-(3,4-dimethylphenyl)phenyl]-1,2-dimethylbenzene;4-[4-[4-(3,4-dimethylphenyl)phenyl]phenyl]-1,2-dimethylbenzene;4-(3,4-dimethylphenyl)sulfonyl-1,2-dimethylbenzene;3,4,9,10-tetramethyl-3a,12c-dihydroperylene;1,2,4,5-tetramethylbenzene;1,2,5,6-tetramethylnaphthalene;2,3,6,7-tetramethylnaphthalene is sourced from PubChem (CID 157335764), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).