1,3-bis(4-methylphenoxy)benzene;1,4-bis(4-methylphenoxy)benzene;9,9-bis(4-methylphenyl)fluorene;5-[(3,5-diethyl-4-methylphenyl)methyl]-1,3-diethyl-2-methylbenzene;1-methyl-3-(4-methylphenoxy)benzene;1-methyl-4-(4-methylphenoxy)benzene;1-methyl-4-[4-[4-(4-methylphenoxy)phenyl]phenoxy]benzene;1-methyl-4-[4-[2-[4-(4-methylphenoxy)phenyl]propan-2-yl]phenoxy]benzene;4-methyl-N-(4-methylphenyl)benzamide;1-methyl-4-[(4-methylphenyl)methyl]benzene;1-methyl-3-(4-methylphenyl)sulfonylbenzene;1-methyl-4-(4-methylphenyl)sulfonylbenzene;1,2,3-trimethyl-5-[(3,4,5-trimethylphenyl)methyl]benzene;1,4-xylene

C258H261NO15S2 — CID 159729164

IUPAC1,3-bis(4-methylphenoxy)benzene;1,4-bis(4-methylphenoxy)benzene;9,9-bis(4-methylphenyl)fluorene;5-[(3,5-diethyl-4-methylphenyl)methyl]-1,3-diethyl-2-methylbenzene;1-methyl-3-(4-methylphenoxy)benzene;1-methyl-4-(4-methylphenoxy)benzene;1-methyl-4-[4-[4-(4-methylphenoxy)phenyl]phenoxy]benzene;1-methyl-4-[4-[2-[4-(4-methylphenoxy)phenyl]propan-2-yl]phenoxy]benzene;4-methyl-N-(4-methylphenyl)benzamide;1-methyl-4-[(4-methylphenyl)methyl]benzene;1-methyl-3-(4-methylphenyl)sulfonylbenzene;1-methyl-4-(4-methylphenyl)sulfonylbenzene;1,2,3-trimethyl-5-[(3,4,5-trimethylphenyl)methyl]benzene;1,4-xylene
SMILESCCc1cc(Cc2cc(CC)c(C)c(CC)c2)cc(CC)c1C.Cc1cc(Cc2cc(C)c(C)c(C)c2)cc(C)c1C.Cc1ccc(C)cc1.Cc1ccc(C2(c3ccc(C)cc3)c3ccccc3-c3ccccc32)cc1.Cc1ccc(Cc2ccc(C)cc2)cc1.Cc1ccc(NC(=O)c2ccc(C)cc2)cc1.Cc1ccc(Oc2ccc(-c3ccc(Oc4ccc(C)cc4)cc3)cc2)cc1.Cc1ccc(Oc2ccc(C(C)(C)c3ccc(Oc4ccc(C)cc4)cc3)cc2)cc1.Cc1ccc(Oc2ccc(C)cc2)cc1.Cc1ccc(Oc2ccc(Oc3ccc(C)cc3)cc2)cc1.Cc1ccc(Oc2cccc(C)c2)cc1.Cc1ccc(Oc2cccc(Oc3ccc(C)cc3)c2)cc1.Cc1ccc(S(=O)(=O)c2ccc(C)cc2)cc1.Cc1ccc(S(=O)(=O)c2cccc(C)c2)cc1
InChIInChI=1S/C29H28O2.C27H22.C26H22O2.C23H32.2C20H18O2.C19H24.C15H15NO.C15H16.2C14H14O2S.2C14H14O.C8H10/c1-21-5-13-25(14-6-21)30-27-17-9-23(10-18-27)29(3,4)24-11-19-28(20-12-24)31-26-15-7-22(2)8-16-26;1-19-11-15-21(16-12-19)27(22-17-13-20(2)14-18-22)25-9-5-3-7-23(25)24-8-4-6-10-26(24)27;1-19-3-11-23(12-4-19)27-25-15-7-21(8-16-25)22-9-17-26(18-10-22)28-24-13-5-20(2)6-14-24;1-7-20-12-18(13-21(8-2)16(20)5)11-19-14-22(9-3)17(6)23(10-4)15-19;1-15-3-7-17(8-4-15)21-19-11-13-20(14-12-19)22-18-9-5-16(2)6-10-18;1-15-6-10-17(11-7-15)21-19-4-3-5-20(14-19)22-18-12-8-16(2)9-13-18;1-12-7-18(8-13(2)16(12)5)11-19-9-14(3)17(6)15(4)10-19;1-11-3-7-13(8-4-11)15(17)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;1-11-3-7-13(8-4-11)17(15,16)14-9-5-12(2)6-10-14;1-11-6-8-13(9-7-11)17(15,16)14-5-3-4-12(2)10-14;1-11-3-7-13(8-4-11)15-14-9-5-12(2)6-10-14;1-11-6-8-13(9-7-11)15-14-5-3-4-12(2)10-14;1-7-3-5-8(2)6-4-7/h5-20H,1-4H3;3-18H,1-2H3;3-18H,1-2H3;12-15H,7-11H2,1-6H3;2*3-14H,1-2H3;7-10H,11H2,1-6H3;3-10H,1-2H3,(H,16,17);3-10H,11H2,1-2H3;2*3-10H,1-2H3;2*3-10H,1-2H3;3-6H,1-2H3
InChIKeyNBACINQPKXBMPE-UHFFFAOYSA-N
MW3680.05 g/mol
LogP69.70
Rot. Bonds41

About 1,3-bis(4-methylphenoxy)benzene;1,4-bis(4-methylphenoxy)benzene;9,9-bis(4-methylphenyl)fluorene;5-[(3,5-diethyl-4-methylphenyl)methyl]-1,3-diethyl-2-methylbenzene;1-methyl-3-(4-methylphenoxy)benzene;1-methyl-4-(4-methylphenoxy)benzene;1-methyl-4-[4-[4-(4-methylphenoxy)phenyl]phenoxy]benzene;1-methyl-4-[4-[2-[4-(4-methylphenoxy)phenyl]propan-2-yl]phenoxy]benzene;4-methyl-N-(4-methylphenyl)benzamide;1-methyl-4-[(4-methylphenyl)methyl]benzene;1-methyl-3-(4-methylphenyl)sulfonylbenzene;1-methyl-4-(4-methylphenyl)sulfonylbenzene;1,2,3-trimethyl-5-[(3,4,5-trimethylphenyl)methyl]benzene;1,4-xylene

1,3-bis(4-methylphenoxy)benzene;1,4-bis(4-methylphenoxy)benzene;9,9-bis(4-methylphenyl)fluorene;5-[(3,5-diethyl-4-methylphenyl)methyl]-1,3-diethyl-2-methylbenzene;1-methyl-3-(4-methylphenoxy)benzene;1-methyl-4-(4-methylphenoxy)benzene;1-methyl-4-[4-[4-(4-methylphenoxy)phenyl]phenoxy]benzene;1-methyl-4-[4-[2-[4-(4-methylphenoxy)phenyl]propan-2-yl]phenoxy]benzene;4-methyl-N-(4-methylphenyl)benzamide;1-methyl-4-[(4-methylphenyl)methyl]benzene;1-methyl-3-(4-methylphenyl)sulfonylbenzene;1-methyl-4-(4-methylphenyl)sulfonylbenzene;1,2,3-trimethyl-5-[(3,4,5-trimethylphenyl)methyl]benzene;1,4-xylene (PubChem CID 159729164) has the molecular formula C258H261NO15S2 and a molecular weight of 3680.05 g/mol. Its IUPAC name is 1,3-bis(4-methylphenoxy)benzene;1,4-bis(4-methylphenoxy)benzene;9,9-bis(4-methylphenyl)fluorene;5-[(3,5-diethyl-4-methylphenyl)methyl]-1,3-diethyl-2-methylbenzene;1-methyl-3-(4-methylphenoxy)benzene;1-methyl-4-(4-methylphenoxy)benzene;1-methyl-4-[4-[4-(4-methylphenoxy)phenyl]phenoxy]benzene;1-methyl-4-[4-[2-[4-(4-methylphenoxy)phenyl]propan-2-yl]phenoxy]benzene;4-methyl-N-(4-methylphenyl)benzamide;1-methyl-4-[(4-methylphenyl)methyl]benzene;1-methyl-3-(4-methylphenyl)sulfonylbenzene;1-methyl-4-(4-methylphenyl)sulfonylbenzene;1,2,3-trimethyl-5-[(3,4,5-trimethylphenyl)methyl]benzene;1,4-xylene.

Molecular Properties

Compound Name1,3-bis(4-methylphenoxy)benzene;1,4-bis(4-methylphenoxy)benzene;9,9-bis(4-methylphenyl)fluorene;5-[(3,5-diethyl-4-methylphenyl)methyl]-1,3-diethyl-2-methylbenzene;1-methyl-3-(4-methylphenoxy)benzene;1-methyl-4-(4-methylphenoxy)benzene;1-methyl-4-[4-[4-(4-methylphenoxy)phenyl]phenoxy]benzene;1-methyl-4-[4-[2-[4-(4-methylphenoxy)phenyl]propan-2-yl]phenoxy]benzene;4-methyl-N-(4-methylphenyl)benzamide;1-methyl-4-[(4-methylphenyl)methyl]benzene;1-methyl-3-(4-methylphenyl)sulfonylbenzene;1-methyl-4-(4-methylphenyl)sulfonylbenzene;1,2,3-trimethyl-5-[(3,4,5-trimethylphenyl)methyl]benzene;1,4-xylene
PubChem CID159729164
Molecular FormulaC258H261NO15S2
Molecular Weight3680.05 g/mol
Exact Mass3676.91
IUPAC Name1,3-bis(4-methylphenoxy)benzene;1,4-bis(4-methylphenoxy)benzene;9,9-bis(4-methylphenyl)fluorene;5-[(3,5-diethyl-4-methylphenyl)methyl]-1,3-diethyl-2-methylbenzene;1-methyl-3-(4-methylphenoxy)benzene;1-methyl-4-(4-methylphenoxy)benzene;1-methyl-4-[4-[4-(4-methylphenoxy)phenyl]phenoxy]benzene;1-methyl-4-[4-[2-[4-(4-methylphenoxy)phenyl]propan-2-yl]phenoxy]benzene;4-methyl-N-(4-methylphenyl)benzamide;1-methyl-4-[(4-methylphenyl)methyl]benzene;1-methyl-3-(4-methylphenyl)sulfonylbenzene;1-methyl-4-(4-methylphenyl)sulfonylbenzene;1,2,3-trimethyl-5-[(3,4,5-trimethylphenyl)methyl]benzene;1,4-xylene
SMILESCCc1cc(Cc2cc(CC)c(C)c(CC)c2)cc(CC)c1C.Cc1cc(Cc2cc(C)c(C)c(C)c2)cc(C)c1C.Cc1ccc(C)cc1.Cc1ccc(C2(c3ccc(C)cc3)c3ccccc3-c3ccccc32)cc1.Cc1ccc(Cc2ccc(C)cc2)cc1.Cc1ccc(NC(=O)c2ccc(C)cc2)cc1.Cc1ccc(Oc2ccc(-c3ccc(Oc4ccc(C)cc4)cc3)cc2)cc1.Cc1ccc(Oc2ccc(C(C)(C)c3ccc(Oc4ccc(C)cc4)cc3)cc2)cc1.Cc1ccc(Oc2ccc(C)cc2)cc1.Cc1ccc(Oc2ccc(Oc3ccc(C)cc3)cc2)cc1.Cc1ccc(Oc2cccc(C)c2)cc1.Cc1ccc(Oc2cccc(Oc3ccc(C)cc3)c2)cc1.Cc1ccc(S(=O)(=O)c2ccc(C)cc2)cc1.Cc1ccc(S(=O)(=O)c2cccc(C)c2)cc1
InChIInChI=1S/C29H28O2.C27H22.C26H22O2.C23H32.2C20H18O2.C19H24.C15H15NO.C15H16.2C14H14O2S.2C14H14O.C8H10/c1-21-5-13-25(14-6-21)30-27-17-9-23(10-18-27)29(3,4)24-11-19-28(20-12-24)31-26-15-7-22(2)8-16-26;1-19-11-15-21(16-12-19)27(22-17-13-20(2)14-18-22)25-9-5-3-7-23(25)24-8-4-6-10-26(24)27;1-19-3-11-23(12-4-19)27-25-15-7-21(8-16-25)22-9-17-26(18-10-22)28-24-13-5-20(2)6-14-24;1-7-20-12-18(13-21(8-2)16(20)5)11-19-14-22(9-3)17(6)23(10-4)15-19;1-15-3-7-17(8-4-15)21-19-11-13-20(14-12-19)22-18-9-5-16(2)6-10-18;1-15-6-10-17(11-7-15)21-19-4-3-5-20(14-19)22-18-12-8-16(2)9-13-18;1-12-7-18(8-13(2)16(12)5)11-19-9-14(3)17(6)15(4)10-19;1-11-3-7-13(8-4-11)15(17)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;1-11-3-7-13(8-4-11)17(15,16)14-9-5-12(2)6-10-14;1-11-6-8-13(9-7-11)17(15,16)14-5-3-4-12(2)10-14;1-11-3-7-13(8-4-11)15-14-9-5-12(2)6-10-14;1-11-6-8-13(9-7-11)15-14-5-3-4-12(2)10-14;1-7-3-5-8(2)6-4-7/h5-20H,1-4H3;3-18H,1-2H3;3-18H,1-2H3;12-15H,7-11H2,1-6H3;2*3-14H,1-2H3;7-10H,11H2,1-6H3;3-10H,1-2H3,(H,16,17);3-10H,11H2,1-2H3;2*3-10H,1-2H3;2*3-10H,1-2H3;3-6H,1-2H3
InChIKeyNBACINQPKXBMPE-UHFFFAOYSA-N
XLogP69.70
TPSA189.68 Ų
H-Bond Donors1
H-Bond Acceptors15
Rotatable Bonds41
Heavy Atoms276
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003680.05
LogP ≤ 569.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 1015

Analyze 1,3-bis(4-methylphenoxy)benzene;1,4-bis(4-methylphenoxy)benzene;9,9-bis(4-methylphenyl)fluorene;5-[(3,5-diethyl-4-methylphenyl)methyl]-1,3-diethyl-2-methylbenzene;1-methyl-3-(4-methylphenoxy)benzene;1-methyl-4-(4-methylphenoxy)benzene;1-methyl-4-[4-[4-(4-methylphenoxy)phenyl]phenoxy]benzene;1-methyl-4-[4-[2-[4-(4-methylphenoxy)phenyl]propan-2-yl]phenoxy]benzene;4-methyl-N-(4-methylphenyl)benzamide;1-methyl-4-[(4-methylphenyl)methyl]benzene;1-methyl-3-(4-methylphenyl)sulfonylbenzene;1-methyl-4-(4-methylphenyl)sulfonylbenzene;1,2,3-trimethyl-5-[(3,4,5-trimethylphenyl)methyl]benzene;1,4-xylene with MolForge

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Related Compounds

1,3-bis(3-methylphenoxy)benzene;1,3-bis(4-methylphenoxy)benzene;9,9-bis(4-methylphenyl)fluorene;4-(3,4-dimethylphenyl)-1,2-dimethylbenzene;1-[1,1,1,3,3,3-hexafluoro-2-[4-(4-methylphenoxy)phenyl]propan-2-yl]-4-(4-methylphenoxy)benzene;1-methyl-3-[4-(4-methylphenoxy)phenoxy]benzene;1-methyl-4-[3-[3-(4-methylphenoxy)phenyl]phenoxy]benzene;1-methyl-4-[4-[4-(4-methylphenoxy)phenyl]phenoxy]benzene;1-methyl-4-[4-[2-[4-(4-methylphenoxy)phenyl]propan-2-yl]phenoxy]benzene;1-methyl-4-[4-[4-(4-methylphenoxy)phenyl]sulfonylphenoxy]benzene;1-(4-methylphenoxy)-3-[3-(4-methylphenoxy)phenyl]sulfonylbenzene
CID 159261526
9,9-bis(4-methylphenyl)fluorene;bis(4-methylphenyl)methanone;2,6-dimethylnaphthalene;1-[1,1,1,3,3,3-hexafluoro-2-(4-methylphenyl)propan-2-yl]-4-methylbenzene;1-methyl-4-(4-methylphenoxy)benzene;1-methyl-4-(4-methylphenyl)benzene;1-methyl-4-[1-(4-methylphenyl)cyclohexyl]benzene;1-methyl-4-[(4-methylphenyl)methyl]benzene;1-methyl-4-[2-(4-methylphenyl)propan-2-yl]benzene;1-methyl-4-(4-methylphenyl)sulfonylbenzene;1,4-xylene
CID 158075946
[4-[4-[9-[4-[4-(4-benzylbenzoyl)phenoxy]phenyl]fluoren-9-yl]phenoxy]phenyl]-(4-methylphenyl)methanone;[4-[4-[4-[4-(4-benzylbenzoyl)phenoxy]-3-phenylphenyl]-2-phenylphenoxy]phenyl]-(4-methylphenyl)methanone;9-[4-[4-(4-benzylphenyl)sulfonylphenoxy]phenyl]-9-[4-[4-(4-methylphenyl)sulfonylphenoxy]phenyl]fluorene;4-[4-[4-(4-benzylphenyl)sulfonylphenoxy]-3-phenylphenyl]-1-[4-(4-methylphenyl)sulfonylphenoxy]-2-phenylbenzene;ethane;methanesulfonic acid
CID 158257887
1-methyl-4-(4-methylphenoxy)benzene;1-methyl-4-[(4-methylphenyl)methyl]benzene;1-methyl-3-(3-methylphenyl)sulfonylbenzene;1-methyl-4-(4-methylphenyl)sulfonylbenzene
CID 158013343
9,9-bis(3,4-dimethylphenyl)fluorene;9,9-bis(4-methylphenyl)fluorene;1-methyl-4-[2-(4-methylphenyl)propan-2-yl]benzene;1-methyl-4-(4-methylphenyl)sulfonylbenzene
CID 161144042
methane;[4-[4-[4-[4-[9-(4-methoxyphenyl)fluoren-9-yl]phenoxy]phenyl]sulfonylphenoxy]phenyl]-(4-methylphenyl)methanone
CID 160735340
4-phenyl-N-[4-[4-[2-[4-[4-[(4-phenylbenzoyl)amino]phenoxy]phenyl]propan-2-yl]phenoxy]phenyl]benzamide
CID 19577181
4-tert-butyl-N-[4-[9-[4-[(4-tert-butylbenzoyl)amino]phenyl]fluoren-9-yl]phenyl]benzamide
CID 3404404
N-[4-(3-methylphenoxy)phenyl]-4-(methylsulfanylmethyl)benzamide
CID 7925023
9,9-bis(4-methylphenyl)fluorene;1-[1,1,1,3,3,3-hexafluoro-2-(4-methylphenyl)propan-2-yl]-4-methylbenzene;1-methyl-4-[(4-methylphenyl)methyl]benzene;1-methyl-4-[2-(4-methylphenyl)propan-2-yl]benzene;1,3-xylene;1,4-xylene
CID 159722596
bis(3,4-dimethylphenyl)methanone;9,9-bis(4-methylphenyl)fluorene;4-(3,4-dimethylphenyl)-1,2-dimethylbenzene;1-methyl-3-(4-methylphenoxy)benzene;1-methyl-4-(4-methylphenoxy)benzene;1-methyl-4-(4-methylphenyl)benzene;1,2,4,5-tetramethylbenzene;1,2,4,5-tetramethylcyclohexane;1,3-xylene;1,4-xylene
CID 161163266
N-(4-acetylphenyl)-4-(3-methylphenoxy)benzamide
CID 16650962

Frequently Asked Questions

What is the IUPAC name of 1,3-bis(4-methylphenoxy)benzene;1,4-bis(4-methylphenoxy)benzene;9,9-bis(4-methylphenyl)fluorene;5-[(3,5-diethyl-4-methylphenyl)methyl]-1,3-diethyl-2-methylbenzene;1-methyl-3-(4-methylphenoxy)benzene;1-methyl-4-(4-methylphenoxy)benzene;1-methyl-4-[4-[4-(4-methylphenoxy)phenyl]phenoxy]benzene;1-methyl-4-[4-[2-[4-(4-methylphenoxy)phenyl]propan-2-yl]phenoxy]benzene;4-methyl-N-(4-methylphenyl)benzamide;1-methyl-4-[(4-methylphenyl)methyl]benzene;1-methyl-3-(4-methylphenyl)sulfonylbenzene;1-methyl-4-(4-methylphenyl)sulfonylbenzene;1,2,3-trimethyl-5-[(3,4,5-trimethylphenyl)methyl]benzene;1,4-xylene?
The IUPAC name of 1,3-bis(4-methylphenoxy)benzene;1,4-bis(4-methylphenoxy)benzene;9,9-bis(4-methylphenyl)fluorene;5-[(3,5-diethyl-4-methylphenyl)methyl]-1,3-diethyl-2-methylbenzene;1-methyl-3-(4-methylphenoxy)benzene;1-methyl-4-(4-methylphenoxy)benzene;1-methyl-4-[4-[4-(4-methylphenoxy)phenyl]phenoxy]benzene;1-methyl-4-[4-[2-[4-(4-methylphenoxy)phenyl]propan-2-yl]phenoxy]benzene;4-methyl-N-(4-methylphenyl)benzamide;1-methyl-4-[(4-methylphenyl)methyl]benzene;1-methyl-3-(4-methylphenyl)sulfonylbenzene;1-methyl-4-(4-methylphenyl)sulfonylbenzene;1,2,3-trimethyl-5-[(3,4,5-trimethylphenyl)methyl]benzene;1,4-xylene (CID 159729164) is 1,3-bis(4-methylphenoxy)benzene;1,4-bis(4-methylphenoxy)benzene;9,9-bis(4-methylphenyl)fluorene;5-[(3,5-diethyl-4-methylphenyl)methyl]-1,3-diethyl-2-methylbenzene;1-methyl-3-(4-methylphenoxy)benzene;1-methyl-4-(4-methylphenoxy)benzene;1-methyl-4-[4-[4-(4-methylphenoxy)phenyl]phenoxy]benzene;1-methyl-4-[4-[2-[4-(4-methylphenoxy)phenyl]propan-2-yl]phenoxy]benzene;4-methyl-N-(4-methylphenyl)benzamide;1-methyl-4-[(4-methylphenyl)methyl]benzene;1-methyl-3-(4-methylphenyl)sulfonylbenzene;1-methyl-4-(4-methylphenyl)sulfonylbenzene;1,2,3-trimethyl-5-[(3,4,5-trimethylphenyl)methyl]benzene;1,4-xylene.
What is the SMILES notation for 1,3-bis(4-methylphenoxy)benzene;1,4-bis(4-methylphenoxy)benzene;9,9-bis(4-methylphenyl)fluorene;5-[(3,5-diethyl-4-methylphenyl)methyl]-1,3-diethyl-2-methylbenzene;1-methyl-3-(4-methylphenoxy)benzene;1-methyl-4-(4-methylphenoxy)benzene;1-methyl-4-[4-[4-(4-methylphenoxy)phenyl]phenoxy]benzene;1-methyl-4-[4-[2-[4-(4-methylphenoxy)phenyl]propan-2-yl]phenoxy]benzene;4-methyl-N-(4-methylphenyl)benzamide;1-methyl-4-[(4-methylphenyl)methyl]benzene;1-methyl-3-(4-methylphenyl)sulfonylbenzene;1-methyl-4-(4-methylphenyl)sulfonylbenzene;1,2,3-trimethyl-5-[(3,4,5-trimethylphenyl)methyl]benzene;1,4-xylene?
The canonical SMILES for 1,3-bis(4-methylphenoxy)benzene;1,4-bis(4-methylphenoxy)benzene;9,9-bis(4-methylphenyl)fluorene;5-[(3,5-diethyl-4-methylphenyl)methyl]-1,3-diethyl-2-methylbenzene;1-methyl-3-(4-methylphenoxy)benzene;1-methyl-4-(4-methylphenoxy)benzene;1-methyl-4-[4-[4-(4-methylphenoxy)phenyl]phenoxy]benzene;1-methyl-4-[4-[2-[4-(4-methylphenoxy)phenyl]propan-2-yl]phenoxy]benzene;4-methyl-N-(4-methylphenyl)benzamide;1-methyl-4-[(4-methylphenyl)methyl]benzene;1-methyl-3-(4-methylphenyl)sulfonylbenzene;1-methyl-4-(4-methylphenyl)sulfonylbenzene;1,2,3-trimethyl-5-[(3,4,5-trimethylphenyl)methyl]benzene;1,4-xylene is CCc1cc(Cc2cc(CC)c(C)c(CC)c2)cc(CC)c1C.Cc1cc(Cc2cc(C)c(C)c(C)c2)cc(C)c1C.Cc1ccc(C)cc1.Cc1ccc(C2(c3ccc(C)cc3)c3ccccc3-c3ccccc32)cc1.Cc1ccc(Cc2ccc(C)cc2)cc1.Cc1ccc(NC(=O)c2ccc(C)cc2)cc1.Cc1ccc(Oc2ccc(-c3ccc(Oc4ccc(C)cc4)cc3)cc2)cc1.Cc1ccc(Oc2ccc(C(C)(C)c3ccc(Oc4ccc(C)cc4)cc3)cc2)cc1.Cc1ccc(Oc2ccc(C)cc2)cc1.Cc1ccc(Oc2ccc(Oc3ccc(C)cc3)cc2)cc1.Cc1ccc(Oc2cccc(C)c2)cc1.Cc1ccc(Oc2cccc(Oc3ccc(C)cc3)c2)cc1.Cc1ccc(S(=O)(=O)c2ccc(C)cc2)cc1.Cc1ccc(S(=O)(=O)c2cccc(C)c2)cc1.
What is the InChIKey of 1,3-bis(4-methylphenoxy)benzene;1,4-bis(4-methylphenoxy)benzene;9,9-bis(4-methylphenyl)fluorene;5-[(3,5-diethyl-4-methylphenyl)methyl]-1,3-diethyl-2-methylbenzene;1-methyl-3-(4-methylphenoxy)benzene;1-methyl-4-(4-methylphenoxy)benzene;1-methyl-4-[4-[4-(4-methylphenoxy)phenyl]phenoxy]benzene;1-methyl-4-[4-[2-[4-(4-methylphenoxy)phenyl]propan-2-yl]phenoxy]benzene;4-methyl-N-(4-methylphenyl)benzamide;1-methyl-4-[(4-methylphenyl)methyl]benzene;1-methyl-3-(4-methylphenyl)sulfonylbenzene;1-methyl-4-(4-methylphenyl)sulfonylbenzene;1,2,3-trimethyl-5-[(3,4,5-trimethylphenyl)methyl]benzene;1,4-xylene?
The InChIKey is NBACINQPKXBMPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H28O2.C27H22.C26H22O2.C23H32.2C20H18O2.C19H24.C15H15NO.C15H16.2C14H14O2S.2C14H14O.C8H10/c1-21-5-13-25(14-6-21)30-27-17-9-23(10-18-27)29(3,4)24-11-19-28(20-12-24)31-26-15-7-22(2)8-16-26;1-19-11-15-21(16-12-19)27(22-17-13-20(2)14-18-22)25-9-5-3-7-23(25)24-8-4-6-10-26(24)27;1-19-3-11-23(12-4-19)27-25-15-7-21(8-16-25)22-9-17-26(18-10-22)28-24-13-5-20(2)6-14-24;1-7-20-12-18(13-21(8-2)16(20)5)11-19-14-22(9-3)17(6)23(10-4)15-19;1-15-3-7-17(8-4-15)21-19-11-13-20(14-12-19)22-18-9-5-16(2)6-10-18;1-15-6-10-17(11-7-15)21-19-4-3-5-20(14-19)22-18-12-8-16(2)9-13-18;1-12-7-18(8-13(2)16(12)5)11-19-9-14(3)17(6)15(4)10-19;1-11-3-7-13(8-4-11)15(17)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;1-11-3-7-13(8-4-11)17(15,16)14-9-5-12(2)6-10-14;1-11-6-8-13(9-7-11)17(15,16)14-5-3-4-12(2)10-14;1-11-3-7-13(8-4-11)15-14-9-5-12(2)6-10-14;1-11-6-8-13(9-7-11)15-14-5-3-4-12(2)10-14;1-7-3-5-8(2)6-4-7/h5-20H,1-4H3;3-18H,1-2H3;3-18H,1-2H3;12-15H,7-11H2,1-6H3;2*3-14H,1-2H3;7-10H,11H2,1-6H3;3-10H,1-2H3,(H,16,17);3-10H,11H2,1-2H3;2*3-10H,1-2H3;2*3-10H,1-2H3;3-6H,1-2H3.
What are the key properties of 1,3-bis(4-methylphenoxy)benzene;1,4-bis(4-methylphenoxy)benzene;9,9-bis(4-methylphenyl)fluorene;5-[(3,5-diethyl-4-methylphenyl)methyl]-1,3-diethyl-2-methylbenzene;1-methyl-3-(4-methylphenoxy)benzene;1-methyl-4-(4-methylphenoxy)benzene;1-methyl-4-[4-[4-(4-methylphenoxy)phenyl]phenoxy]benzene;1-methyl-4-[4-[2-[4-(4-methylphenoxy)phenyl]propan-2-yl]phenoxy]benzene;4-methyl-N-(4-methylphenyl)benzamide;1-methyl-4-[(4-methylphenyl)methyl]benzene;1-methyl-3-(4-methylphenyl)sulfonylbenzene;1-methyl-4-(4-methylphenyl)sulfonylbenzene;1,2,3-trimethyl-5-[(3,4,5-trimethylphenyl)methyl]benzene;1,4-xylene?
1,3-bis(4-methylphenoxy)benzene;1,4-bis(4-methylphenoxy)benzene;9,9-bis(4-methylphenyl)fluorene;5-[(3,5-diethyl-4-methylphenyl)methyl]-1,3-diethyl-2-methylbenzene;1-methyl-3-(4-methylphenoxy)benzene;1-methyl-4-(4-methylphenoxy)benzene;1-methyl-4-[4-[4-(4-methylphenoxy)phenyl]phenoxy]benzene;1-methyl-4-[4-[2-[4-(4-methylphenoxy)phenyl]propan-2-yl]phenoxy]benzene;4-methyl-N-(4-methylphenyl)benzamide;1-methyl-4-[(4-methylphenyl)methyl]benzene;1-methyl-3-(4-methylphenyl)sulfonylbenzene;1-methyl-4-(4-methylphenyl)sulfonylbenzene;1,2,3-trimethyl-5-[(3,4,5-trimethylphenyl)methyl]benzene;1,4-xylene has a molecular weight of 3680.05 g/mol, XLogP of 69.70, 41 rotatable bonds, 1 hydrogen bond donors, and 15 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-bis(4-methylphenoxy)benzene;1,4-bis(4-methylphenoxy)benzene;9,9-bis(4-methylphenyl)fluorene;5-[(3,5-diethyl-4-methylphenyl)methyl]-1,3-diethyl-2-methylbenzene;1-methyl-3-(4-methylphenoxy)benzene;1-methyl-4-(4-methylphenoxy)benzene;1-methyl-4-[4-[4-(4-methylphenoxy)phenyl]phenoxy]benzene;1-methyl-4-[4-[2-[4-(4-methylphenoxy)phenyl]propan-2-yl]phenoxy]benzene;4-methyl-N-(4-methylphenyl)benzamide;1-methyl-4-[(4-methylphenyl)methyl]benzene;1-methyl-3-(4-methylphenyl)sulfonylbenzene;1-methyl-4-(4-methylphenyl)sulfonylbenzene;1,2,3-trimethyl-5-[(3,4,5-trimethylphenyl)methyl]benzene;1,4-xylene is sourced from PubChem (CID 159729164), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).