1,1-bis(3,4-dimethylphenyl)ethanol;bis(3,4-dimethylphenyl)methanol;2-(3,4-dimethylbenzoyl)oxyethyl 3,4-dimethylbenzoate;4-[3-(3,4-dimethylphenoxy)phenoxy]-1,2-dimethylbenzene;4-[4-(3,4-dimethylphenoxy)phenoxy]-1,2-dimethylbenzene;4-[4-[4-(3,4-dimethylphenoxy)phenoxy]phenoxy]-1,2-dimethylbenzene;4-[4-[4-(3,4-dimethylphenoxy)phenyl]sulfonylphenoxy]-1,2-dimethylbenzene;1-(2,3-dimethylphenyl)-2,3-dimethylbenzene;4-[[4-[(3,4-dimethylphenyl)methyl]phenyl]methyl]-1,2-dimethylbenzene;4-[4-(3,4-dimethylphenyl)phenyl]-1,2-dimethylbenzene;2,3,6,7,9-pentamethyl-9-(trifluoromethyl)xanthene;1,2,4,5-tetramethyl-3,6-bis(trifluoromethyl)benzene;1,2,4,5-tetramethyl-3-(trifluoromethyl)benzene

C259H270F12O18S — CID 158164737

IUPAC1,1-bis(3,4-dimethylphenyl)ethanol;bis(3,4-dimethylphenyl)methanol;2-(3,4-dimethylbenzoyl)oxyethyl 3,4-dimethylbenzoate;4-[3-(3,4-dimethylphenoxy)phenoxy]-1,2-dimethylbenzene;4-[4-(3,4-dimethylphenoxy)phenoxy]-1,2-dimethylbenzene;4-[4-[4-(3,4-dimethylphenoxy)phenoxy]phenoxy]-1,2-dimethylbenzene;4-[4-[4-(3,4-dimethylphenoxy)phenyl]sulfonylphenoxy]-1,2-dimethylbenzene;1-(2,3-dimethylphenyl)-2,3-dimethylbenzene;4-[[4-[(3,4-dimethylphenyl)methyl]phenyl]methyl]-1,2-dimethylbenzene;4-[4-(3,4-dimethylphenyl)phenyl]-1,2-dimethylbenzene;2,3,6,7,9-pentamethyl-9-(trifluoromethyl)xanthene;1,2,4,5-tetramethyl-3,6-bis(trifluoromethyl)benzene;1,2,4,5-tetramethyl-3-(trifluoromethyl)benzene
SMILESCc1c(C)c(C(F)(F)F)c(C)c(C)c1C(F)(F)F.Cc1cc(C)c(C)c(C(F)(F)F)c1C.Cc1cc2c(cc1C)C(C)(C(F)(F)F)c1cc(C)c(C)cc1O2.Cc1ccc(-c2ccc(-c3ccc(C)c(C)c3)cc2)cc1C.Cc1ccc(C(=O)OCCOC(=O)c2ccc(C)c(C)c2)cc1C.Cc1ccc(C(C)(O)c2ccc(C)c(C)c2)cc1C.Cc1ccc(C(O)c2ccc(C)c(C)c2)cc1C.Cc1ccc(Cc2ccc(Cc3ccc(C)c(C)c3)cc2)cc1C.Cc1ccc(Oc2ccc(Oc3ccc(C)c(C)c3)cc2)cc1C.Cc1ccc(Oc2ccc(Oc3ccc(Oc4ccc(C)c(C)c4)cc3)cc2)cc1C.Cc1ccc(Oc2ccc(S(=O)(=O)c3ccc(Oc4ccc(C)c(C)c4)cc3)cc2)cc1C.Cc1ccc(Oc2cccc(Oc3ccc(C)c(C)c3)c2)cc1C.Cc1cccc(-c2cccc(C)c2C)c1C
InChIInChI=1S/C28H26O4S.C28H26O3.C24H26.2C22H22O2.C22H22.C20H22O4.C19H19F3O.C18H22O.C17H20O.C16H18.C12H12F6.C11H13F3/c1-19-5-7-25(17-21(19)3)31-23-9-13-27(14-10-23)33(29,30)28-15-11-24(12-16-28)32-26-8-6-20(2)22(4)18-26;1-19-5-7-27(17-21(19)3)30-25-13-9-23(10-14-25)29-24-11-15-26(16-12-24)31-28-8-6-20(2)22(4)18-28;1-17-5-7-23(13-19(17)3)15-21-9-11-22(12-10-21)16-24-8-6-18(2)20(4)14-24;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;1-15-8-10-21(12-17(15)3)23-19-6-5-7-20(14-19)24-22-11-9-16(2)18(4)13-22;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;1-13-5-7-17(11-15(13)3)19(21)23-9-10-24-20(22)18-8-6-14(2)16(4)12-18;1-10-6-14-16(8-12(10)3)23-17-9-13(4)11(2)7-15(17)18(14,5)19(20,21)22;1-12-6-8-16(10-14(12)3)18(5,19)17-9-7-13(2)15(4)11-17;1-11-5-7-15(9-13(11)3)17(18)16-8-6-12(2)14(4)10-16;1-11-7-5-9-15(13(11)3)16-10-6-8-12(2)14(16)4;1-5-6(2)10(12(16,17)18)8(4)7(3)9(5)11(13,14)15;1-6-5-7(2)9(4)10(8(6)3)11(12,13)14/h5-18H,1-4H3;5-18H,1-4H3;5-14H,15-16H2,1-4H3;2*5-14H,1-4H3;5-14H,1-4H3;5-8,11-12H,9-10H2,1-4H3;6-9H,1-5H3;6-11,19H,1-5H3;5-10,17-18H,1-4H3;5-10H,1-4H3;1-4H3;5H,1-4H3
InChIKeyFWRXIDJRAPZEGX-UHFFFAOYSA-N
MW3931.03 g/mol
LogP72.49
Rot. Bonds36

About 1,1-bis(3,4-dimethylphenyl)ethanol;bis(3,4-dimethylphenyl)methanol;2-(3,4-dimethylbenzoyl)oxyethyl 3,4-dimethylbenzoate;4-[3-(3,4-dimethylphenoxy)phenoxy]-1,2-dimethylbenzene;4-[4-(3,4-dimethylphenoxy)phenoxy]-1,2-dimethylbenzene;4-[4-[4-(3,4-dimethylphenoxy)phenoxy]phenoxy]-1,2-dimethylbenzene;4-[4-[4-(3,4-dimethylphenoxy)phenyl]sulfonylphenoxy]-1,2-dimethylbenzene;1-(2,3-dimethylphenyl)-2,3-dimethylbenzene;4-[[4-[(3,4-dimethylphenyl)methyl]phenyl]methyl]-1,2-dimethylbenzene;4-[4-(3,4-dimethylphenyl)phenyl]-1,2-dimethylbenzene;2,3,6,7,9-pentamethyl-9-(trifluoromethyl)xanthene;1,2,4,5-tetramethyl-3,6-bis(trifluoromethyl)benzene;1,2,4,5-tetramethyl-3-(trifluoromethyl)benzene

1,1-bis(3,4-dimethylphenyl)ethanol;bis(3,4-dimethylphenyl)methanol;2-(3,4-dimethylbenzoyl)oxyethyl 3,4-dimethylbenzoate;4-[3-(3,4-dimethylphenoxy)phenoxy]-1,2-dimethylbenzene;4-[4-(3,4-dimethylphenoxy)phenoxy]-1,2-dimethylbenzene;4-[4-[4-(3,4-dimethylphenoxy)phenoxy]phenoxy]-1,2-dimethylbenzene;4-[4-[4-(3,4-dimethylphenoxy)phenyl]sulfonylphenoxy]-1,2-dimethylbenzene;1-(2,3-dimethylphenyl)-2,3-dimethylbenzene;4-[[4-[(3,4-dimethylphenyl)methyl]phenyl]methyl]-1,2-dimethylbenzene;4-[4-(3,4-dimethylphenyl)phenyl]-1,2-dimethylbenzene;2,3,6,7,9-pentamethyl-9-(trifluoromethyl)xanthene;1,2,4,5-tetramethyl-3,6-bis(trifluoromethyl)benzene;1,2,4,5-tetramethyl-3-(trifluoromethyl)benzene (PubChem CID 158164737) has the molecular formula C259H270F12O18S and a molecular weight of 3931.03 g/mol. Its IUPAC name is 1,1-bis(3,4-dimethylphenyl)ethanol;bis(3,4-dimethylphenyl)methanol;2-(3,4-dimethylbenzoyl)oxyethyl 3,4-dimethylbenzoate;4-[3-(3,4-dimethylphenoxy)phenoxy]-1,2-dimethylbenzene;4-[4-(3,4-dimethylphenoxy)phenoxy]-1,2-dimethylbenzene;4-[4-[4-(3,4-dimethylphenoxy)phenoxy]phenoxy]-1,2-dimethylbenzene;4-[4-[4-(3,4-dimethylphenoxy)phenyl]sulfonylphenoxy]-1,2-dimethylbenzene;1-(2,3-dimethylphenyl)-2,3-dimethylbenzene;4-[[4-[(3,4-dimethylphenyl)methyl]phenyl]methyl]-1,2-dimethylbenzene;4-[4-(3,4-dimethylphenyl)phenyl]-1,2-dimethylbenzene;2,3,6,7,9-pentamethyl-9-(trifluoromethyl)xanthene;1,2,4,5-tetramethyl-3,6-bis(trifluoromethyl)benzene;1,2,4,5-tetramethyl-3-(trifluoromethyl)benzene.

Molecular Properties

Compound Name1,1-bis(3,4-dimethylphenyl)ethanol;bis(3,4-dimethylphenyl)methanol;2-(3,4-dimethylbenzoyl)oxyethyl 3,4-dimethylbenzoate;4-[3-(3,4-dimethylphenoxy)phenoxy]-1,2-dimethylbenzene;4-[4-(3,4-dimethylphenoxy)phenoxy]-1,2-dimethylbenzene;4-[4-[4-(3,4-dimethylphenoxy)phenoxy]phenoxy]-1,2-dimethylbenzene;4-[4-[4-(3,4-dimethylphenoxy)phenyl]sulfonylphenoxy]-1,2-dimethylbenzene;1-(2,3-dimethylphenyl)-2,3-dimethylbenzene;4-[[4-[(3,4-dimethylphenyl)methyl]phenyl]methyl]-1,2-dimethylbenzene;4-[4-(3,4-dimethylphenyl)phenyl]-1,2-dimethylbenzene;2,3,6,7,9-pentamethyl-9-(trifluoromethyl)xanthene;1,2,4,5-tetramethyl-3,6-bis(trifluoromethyl)benzene;1,2,4,5-tetramethyl-3-(trifluoromethyl)benzene
PubChem CID158164737
Molecular FormulaC259H270F12O18S
Molecular Weight3931.03 g/mol
Exact Mass3927.97
IUPAC Name1,1-bis(3,4-dimethylphenyl)ethanol;bis(3,4-dimethylphenyl)methanol;2-(3,4-dimethylbenzoyl)oxyethyl 3,4-dimethylbenzoate;4-[3-(3,4-dimethylphenoxy)phenoxy]-1,2-dimethylbenzene;4-[4-(3,4-dimethylphenoxy)phenoxy]-1,2-dimethylbenzene;4-[4-[4-(3,4-dimethylphenoxy)phenoxy]phenoxy]-1,2-dimethylbenzene;4-[4-[4-(3,4-dimethylphenoxy)phenyl]sulfonylphenoxy]-1,2-dimethylbenzene;1-(2,3-dimethylphenyl)-2,3-dimethylbenzene;4-[[4-[(3,4-dimethylphenyl)methyl]phenyl]methyl]-1,2-dimethylbenzene;4-[4-(3,4-dimethylphenyl)phenyl]-1,2-dimethylbenzene;2,3,6,7,9-pentamethyl-9-(trifluoromethyl)xanthene;1,2,4,5-tetramethyl-3,6-bis(trifluoromethyl)benzene;1,2,4,5-tetramethyl-3-(trifluoromethyl)benzene
SMILESCc1c(C)c(C(F)(F)F)c(C)c(C)c1C(F)(F)F.Cc1cc(C)c(C)c(C(F)(F)F)c1C.Cc1cc2c(cc1C)C(C)(C(F)(F)F)c1cc(C)c(C)cc1O2.Cc1ccc(-c2ccc(-c3ccc(C)c(C)c3)cc2)cc1C.Cc1ccc(C(=O)OCCOC(=O)c2ccc(C)c(C)c2)cc1C.Cc1ccc(C(C)(O)c2ccc(C)c(C)c2)cc1C.Cc1ccc(C(O)c2ccc(C)c(C)c2)cc1C.Cc1ccc(Cc2ccc(Cc3ccc(C)c(C)c3)cc2)cc1C.Cc1ccc(Oc2ccc(Oc3ccc(C)c(C)c3)cc2)cc1C.Cc1ccc(Oc2ccc(Oc3ccc(Oc4ccc(C)c(C)c4)cc3)cc2)cc1C.Cc1ccc(Oc2ccc(S(=O)(=O)c3ccc(Oc4ccc(C)c(C)c4)cc3)cc2)cc1C.Cc1ccc(Oc2cccc(Oc3ccc(C)c(C)c3)c2)cc1C.Cc1cccc(-c2cccc(C)c2C)c1C
InChIInChI=1S/C28H26O4S.C28H26O3.C24H26.2C22H22O2.C22H22.C20H22O4.C19H19F3O.C18H22O.C17H20O.C16H18.C12H12F6.C11H13F3/c1-19-5-7-25(17-21(19)3)31-23-9-13-27(14-10-23)33(29,30)28-15-11-24(12-16-28)32-26-8-6-20(2)22(4)18-26;1-19-5-7-27(17-21(19)3)30-25-13-9-23(10-14-25)29-24-11-15-26(16-12-24)31-28-8-6-20(2)22(4)18-28;1-17-5-7-23(13-19(17)3)15-21-9-11-22(12-10-21)16-24-8-6-18(2)20(4)14-24;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;1-15-8-10-21(12-17(15)3)23-19-6-5-7-20(14-19)24-22-11-9-16(2)18(4)13-22;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;1-13-5-7-17(11-15(13)3)19(21)23-9-10-24-20(22)18-8-6-14(2)16(4)12-18;1-10-6-14-16(8-12(10)3)23-17-9-13(4)11(2)7-15(17)18(14,5)19(20,21)22;1-12-6-8-16(10-14(12)3)18(5,19)17-9-7-13(2)15(4)11-17;1-11-5-7-15(9-13(11)3)17(18)16-8-6-12(2)14(4)10-16;1-11-7-5-9-15(13(11)3)16-10-6-8-12(2)14(16)4;1-5-6(2)10(12(16,17)18)8(4)7(3)9(5)11(13,14)15;1-6-5-7(2)9(4)10(8(6)3)11(12,13)14/h5-18H,1-4H3;5-18H,1-4H3;5-14H,15-16H2,1-4H3;2*5-14H,1-4H3;5-14H,1-4H3;5-8,11-12H,9-10H2,1-4H3;6-9H,1-5H3;6-11,19H,1-5H3;5-10,17-18H,1-4H3;5-10H,1-4H3;1-4H3;5H,1-4H3
InChIKeyFWRXIDJRAPZEGX-UHFFFAOYSA-N
XLogP72.49
TPSA219.50 Ų
H-Bond Donors2
H-Bond Acceptors18
Rotatable Bonds36
Heavy Atoms290
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003931.03
LogP ≤ 572.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 1018

Analyze 1,1-bis(3,4-dimethylphenyl)ethanol;bis(3,4-dimethylphenyl)methanol;2-(3,4-dimethylbenzoyl)oxyethyl 3,4-dimethylbenzoate;4-[3-(3,4-dimethylphenoxy)phenoxy]-1,2-dimethylbenzene;4-[4-(3,4-dimethylphenoxy)phenoxy]-1,2-dimethylbenzene;4-[4-[4-(3,4-dimethylphenoxy)phenoxy]phenoxy]-1,2-dimethylbenzene;4-[4-[4-(3,4-dimethylphenoxy)phenyl]sulfonylphenoxy]-1,2-dimethylbenzene;1-(2,3-dimethylphenyl)-2,3-dimethylbenzene;4-[[4-[(3,4-dimethylphenyl)methyl]phenyl]methyl]-1,2-dimethylbenzene;4-[4-(3,4-dimethylphenyl)phenyl]-1,2-dimethylbenzene;2,3,6,7,9-pentamethyl-9-(trifluoromethyl)xanthene;1,2,4,5-tetramethyl-3,6-bis(trifluoromethyl)benzene;1,2,4,5-tetramethyl-3-(trifluoromethyl)benzene with MolForge

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Frequently Asked Questions

What is the IUPAC name of 1,1-bis(3,4-dimethylphenyl)ethanol;bis(3,4-dimethylphenyl)methanol;2-(3,4-dimethylbenzoyl)oxyethyl 3,4-dimethylbenzoate;4-[3-(3,4-dimethylphenoxy)phenoxy]-1,2-dimethylbenzene;4-[4-(3,4-dimethylphenoxy)phenoxy]-1,2-dimethylbenzene;4-[4-[4-(3,4-dimethylphenoxy)phenoxy]phenoxy]-1,2-dimethylbenzene;4-[4-[4-(3,4-dimethylphenoxy)phenyl]sulfonylphenoxy]-1,2-dimethylbenzene;1-(2,3-dimethylphenyl)-2,3-dimethylbenzene;4-[[4-[(3,4-dimethylphenyl)methyl]phenyl]methyl]-1,2-dimethylbenzene;4-[4-(3,4-dimethylphenyl)phenyl]-1,2-dimethylbenzene;2,3,6,7,9-pentamethyl-9-(trifluoromethyl)xanthene;1,2,4,5-tetramethyl-3,6-bis(trifluoromethyl)benzene;1,2,4,5-tetramethyl-3-(trifluoromethyl)benzene?
The IUPAC name of 1,1-bis(3,4-dimethylphenyl)ethanol;bis(3,4-dimethylphenyl)methanol;2-(3,4-dimethylbenzoyl)oxyethyl 3,4-dimethylbenzoate;4-[3-(3,4-dimethylphenoxy)phenoxy]-1,2-dimethylbenzene;4-[4-(3,4-dimethylphenoxy)phenoxy]-1,2-dimethylbenzene;4-[4-[4-(3,4-dimethylphenoxy)phenoxy]phenoxy]-1,2-dimethylbenzene;4-[4-[4-(3,4-dimethylphenoxy)phenyl]sulfonylphenoxy]-1,2-dimethylbenzene;1-(2,3-dimethylphenyl)-2,3-dimethylbenzene;4-[[4-[(3,4-dimethylphenyl)methyl]phenyl]methyl]-1,2-dimethylbenzene;4-[4-(3,4-dimethylphenyl)phenyl]-1,2-dimethylbenzene;2,3,6,7,9-pentamethyl-9-(trifluoromethyl)xanthene;1,2,4,5-tetramethyl-3,6-bis(trifluoromethyl)benzene;1,2,4,5-tetramethyl-3-(trifluoromethyl)benzene (CID 158164737) is 1,1-bis(3,4-dimethylphenyl)ethanol;bis(3,4-dimethylphenyl)methanol;2-(3,4-dimethylbenzoyl)oxyethyl 3,4-dimethylbenzoate;4-[3-(3,4-dimethylphenoxy)phenoxy]-1,2-dimethylbenzene;4-[4-(3,4-dimethylphenoxy)phenoxy]-1,2-dimethylbenzene;4-[4-[4-(3,4-dimethylphenoxy)phenoxy]phenoxy]-1,2-dimethylbenzene;4-[4-[4-(3,4-dimethylphenoxy)phenyl]sulfonylphenoxy]-1,2-dimethylbenzene;1-(2,3-dimethylphenyl)-2,3-dimethylbenzene;4-[[4-[(3,4-dimethylphenyl)methyl]phenyl]methyl]-1,2-dimethylbenzene;4-[4-(3,4-dimethylphenyl)phenyl]-1,2-dimethylbenzene;2,3,6,7,9-pentamethyl-9-(trifluoromethyl)xanthene;1,2,4,5-tetramethyl-3,6-bis(trifluoromethyl)benzene;1,2,4,5-tetramethyl-3-(trifluoromethyl)benzene.
What is the SMILES notation for 1,1-bis(3,4-dimethylphenyl)ethanol;bis(3,4-dimethylphenyl)methanol;2-(3,4-dimethylbenzoyl)oxyethyl 3,4-dimethylbenzoate;4-[3-(3,4-dimethylphenoxy)phenoxy]-1,2-dimethylbenzene;4-[4-(3,4-dimethylphenoxy)phenoxy]-1,2-dimethylbenzene;4-[4-[4-(3,4-dimethylphenoxy)phenoxy]phenoxy]-1,2-dimethylbenzene;4-[4-[4-(3,4-dimethylphenoxy)phenyl]sulfonylphenoxy]-1,2-dimethylbenzene;1-(2,3-dimethylphenyl)-2,3-dimethylbenzene;4-[[4-[(3,4-dimethylphenyl)methyl]phenyl]methyl]-1,2-dimethylbenzene;4-[4-(3,4-dimethylphenyl)phenyl]-1,2-dimethylbenzene;2,3,6,7,9-pentamethyl-9-(trifluoromethyl)xanthene;1,2,4,5-tetramethyl-3,6-bis(trifluoromethyl)benzene;1,2,4,5-tetramethyl-3-(trifluoromethyl)benzene?
The canonical SMILES for 1,1-bis(3,4-dimethylphenyl)ethanol;bis(3,4-dimethylphenyl)methanol;2-(3,4-dimethylbenzoyl)oxyethyl 3,4-dimethylbenzoate;4-[3-(3,4-dimethylphenoxy)phenoxy]-1,2-dimethylbenzene;4-[4-(3,4-dimethylphenoxy)phenoxy]-1,2-dimethylbenzene;4-[4-[4-(3,4-dimethylphenoxy)phenoxy]phenoxy]-1,2-dimethylbenzene;4-[4-[4-(3,4-dimethylphenoxy)phenyl]sulfonylphenoxy]-1,2-dimethylbenzene;1-(2,3-dimethylphenyl)-2,3-dimethylbenzene;4-[[4-[(3,4-dimethylphenyl)methyl]phenyl]methyl]-1,2-dimethylbenzene;4-[4-(3,4-dimethylphenyl)phenyl]-1,2-dimethylbenzene;2,3,6,7,9-pentamethyl-9-(trifluoromethyl)xanthene;1,2,4,5-tetramethyl-3,6-bis(trifluoromethyl)benzene;1,2,4,5-tetramethyl-3-(trifluoromethyl)benzene is Cc1c(C)c(C(F)(F)F)c(C)c(C)c1C(F)(F)F.Cc1cc(C)c(C)c(C(F)(F)F)c1C.Cc1cc2c(cc1C)C(C)(C(F)(F)F)c1cc(C)c(C)cc1O2.Cc1ccc(-c2ccc(-c3ccc(C)c(C)c3)cc2)cc1C.Cc1ccc(C(=O)OCCOC(=O)c2ccc(C)c(C)c2)cc1C.Cc1ccc(C(C)(O)c2ccc(C)c(C)c2)cc1C.Cc1ccc(C(O)c2ccc(C)c(C)c2)cc1C.Cc1ccc(Cc2ccc(Cc3ccc(C)c(C)c3)cc2)cc1C.Cc1ccc(Oc2ccc(Oc3ccc(C)c(C)c3)cc2)cc1C.Cc1ccc(Oc2ccc(Oc3ccc(Oc4ccc(C)c(C)c4)cc3)cc2)cc1C.Cc1ccc(Oc2ccc(S(=O)(=O)c3ccc(Oc4ccc(C)c(C)c4)cc3)cc2)cc1C.Cc1ccc(Oc2cccc(Oc3ccc(C)c(C)c3)c2)cc1C.Cc1cccc(-c2cccc(C)c2C)c1C.
What is the InChIKey of 1,1-bis(3,4-dimethylphenyl)ethanol;bis(3,4-dimethylphenyl)methanol;2-(3,4-dimethylbenzoyl)oxyethyl 3,4-dimethylbenzoate;4-[3-(3,4-dimethylphenoxy)phenoxy]-1,2-dimethylbenzene;4-[4-(3,4-dimethylphenoxy)phenoxy]-1,2-dimethylbenzene;4-[4-[4-(3,4-dimethylphenoxy)phenoxy]phenoxy]-1,2-dimethylbenzene;4-[4-[4-(3,4-dimethylphenoxy)phenyl]sulfonylphenoxy]-1,2-dimethylbenzene;1-(2,3-dimethylphenyl)-2,3-dimethylbenzene;4-[[4-[(3,4-dimethylphenyl)methyl]phenyl]methyl]-1,2-dimethylbenzene;4-[4-(3,4-dimethylphenyl)phenyl]-1,2-dimethylbenzene;2,3,6,7,9-pentamethyl-9-(trifluoromethyl)xanthene;1,2,4,5-tetramethyl-3,6-bis(trifluoromethyl)benzene;1,2,4,5-tetramethyl-3-(trifluoromethyl)benzene?
The InChIKey is FWRXIDJRAPZEGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H26O4S.C28H26O3.C24H26.2C22H22O2.C22H22.C20H22O4.C19H19F3O.C18H22O.C17H20O.C16H18.C12H12F6.C11H13F3/c1-19-5-7-25(17-21(19)3)31-23-9-13-27(14-10-23)33(29,30)28-15-11-24(12-16-28)32-26-8-6-20(2)22(4)18-26;1-19-5-7-27(17-21(19)3)30-25-13-9-23(10-14-25)29-24-11-15-26(16-12-24)31-28-8-6-20(2)22(4)18-28;1-17-5-7-23(13-19(17)3)15-21-9-11-22(12-10-21)16-24-8-6-18(2)20(4)14-24;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;1-15-8-10-21(12-17(15)3)23-19-6-5-7-20(14-19)24-22-11-9-16(2)18(4)13-22;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;1-13-5-7-17(11-15(13)3)19(21)23-9-10-24-20(22)18-8-6-14(2)16(4)12-18;1-10-6-14-16(8-12(10)3)23-17-9-13(4)11(2)7-15(17)18(14,5)19(20,21)22;1-12-6-8-16(10-14(12)3)18(5,19)17-9-7-13(2)15(4)11-17;1-11-5-7-15(9-13(11)3)17(18)16-8-6-12(2)14(4)10-16;1-11-7-5-9-15(13(11)3)16-10-6-8-12(2)14(16)4;1-5-6(2)10(12(16,17)18)8(4)7(3)9(5)11(13,14)15;1-6-5-7(2)9(4)10(8(6)3)11(12,13)14/h5-18H,1-4H3;5-18H,1-4H3;5-14H,15-16H2,1-4H3;2*5-14H,1-4H3;5-14H,1-4H3;5-8,11-12H,9-10H2,1-4H3;6-9H,1-5H3;6-11,19H,1-5H3;5-10,17-18H,1-4H3;5-10H,1-4H3;1-4H3;5H,1-4H3.
What are the key properties of 1,1-bis(3,4-dimethylphenyl)ethanol;bis(3,4-dimethylphenyl)methanol;2-(3,4-dimethylbenzoyl)oxyethyl 3,4-dimethylbenzoate;4-[3-(3,4-dimethylphenoxy)phenoxy]-1,2-dimethylbenzene;4-[4-(3,4-dimethylphenoxy)phenoxy]-1,2-dimethylbenzene;4-[4-[4-(3,4-dimethylphenoxy)phenoxy]phenoxy]-1,2-dimethylbenzene;4-[4-[4-(3,4-dimethylphenoxy)phenyl]sulfonylphenoxy]-1,2-dimethylbenzene;1-(2,3-dimethylphenyl)-2,3-dimethylbenzene;4-[[4-[(3,4-dimethylphenyl)methyl]phenyl]methyl]-1,2-dimethylbenzene;4-[4-(3,4-dimethylphenyl)phenyl]-1,2-dimethylbenzene;2,3,6,7,9-pentamethyl-9-(trifluoromethyl)xanthene;1,2,4,5-tetramethyl-3,6-bis(trifluoromethyl)benzene;1,2,4,5-tetramethyl-3-(trifluoromethyl)benzene?
1,1-bis(3,4-dimethylphenyl)ethanol;bis(3,4-dimethylphenyl)methanol;2-(3,4-dimethylbenzoyl)oxyethyl 3,4-dimethylbenzoate;4-[3-(3,4-dimethylphenoxy)phenoxy]-1,2-dimethylbenzene;4-[4-(3,4-dimethylphenoxy)phenoxy]-1,2-dimethylbenzene;4-[4-[4-(3,4-dimethylphenoxy)phenoxy]phenoxy]-1,2-dimethylbenzene;4-[4-[4-(3,4-dimethylphenoxy)phenyl]sulfonylphenoxy]-1,2-dimethylbenzene;1-(2,3-dimethylphenyl)-2,3-dimethylbenzene;4-[[4-[(3,4-dimethylphenyl)methyl]phenyl]methyl]-1,2-dimethylbenzene;4-[4-(3,4-dimethylphenyl)phenyl]-1,2-dimethylbenzene;2,3,6,7,9-pentamethyl-9-(trifluoromethyl)xanthene;1,2,4,5-tetramethyl-3,6-bis(trifluoromethyl)benzene;1,2,4,5-tetramethyl-3-(trifluoromethyl)benzene has a molecular weight of 3931.03 g/mol, XLogP of 72.49, 36 rotatable bonds, 2 hydrogen bond donors, and 18 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1-bis(3,4-dimethylphenyl)ethanol;bis(3,4-dimethylphenyl)methanol;2-(3,4-dimethylbenzoyl)oxyethyl 3,4-dimethylbenzoate;4-[3-(3,4-dimethylphenoxy)phenoxy]-1,2-dimethylbenzene;4-[4-(3,4-dimethylphenoxy)phenoxy]-1,2-dimethylbenzene;4-[4-[4-(3,4-dimethylphenoxy)phenoxy]phenoxy]-1,2-dimethylbenzene;4-[4-[4-(3,4-dimethylphenoxy)phenyl]sulfonylphenoxy]-1,2-dimethylbenzene;1-(2,3-dimethylphenyl)-2,3-dimethylbenzene;4-[[4-[(3,4-dimethylphenyl)methyl]phenyl]methyl]-1,2-dimethylbenzene;4-[4-(3,4-dimethylphenyl)phenyl]-1,2-dimethylbenzene;2,3,6,7,9-pentamethyl-9-(trifluoromethyl)xanthene;1,2,4,5-tetramethyl-3,6-bis(trifluoromethyl)benzene;1,2,4,5-tetramethyl-3-(trifluoromethyl)benzene is sourced from PubChem (CID 158164737), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).