tetrakis(2-[3-(2,2-dimethyl-3-octadecoxy-3-oxopropyl)sulfanylpropanoyloxy]ethyl 2,2-dimethylbutanoate);2-[3-(3-dodecoxy-2,2-dimethyl-3-oxopropyl)sulfanylpropanoyloxy]ethyl 2,2-dimethylbutanoate;2-[3-[3-(2-ethylhexoxy)-2,2-dimethyl-3-oxopropyl]sulfanylpropanoyloxy]ethyl 2,2-dimethylbutanoate;N-ethyl-4-(2-methylbutan-2-yl)benzamide;1-methoxy-4-(2-methylbutan-2-yl)benzene;2-methylbutan-2-ylbenzene;1-(2-methylbutan-2-yl)-4-[(2-methylpropan-2-yl)oxy]benzene;bis([4-(2-methylbutan-2-yl)phenyl] acetate);bis(1-methyl-4-(2-methylbutan-2-yl)benzene);methyl 4-(2-methylbutan-2-yl)benzoate

C303H521NO45S6 — CID 158832667

IUPACtetrakis(2-[3-(2,2-dimethyl-3-octadecoxy-3-oxopropyl)sulfanylpropanoyloxy]ethyl 2,2-dimethylbutanoate);2-[3-(3-dodecoxy-2,2-dimethyl-3-oxopropyl)sulfanylpropanoyloxy]ethyl 2,2-dimethylbutanoate;2-[3-[3-(2-ethylhexoxy)-2,2-dimethyl-3-oxopropyl]sulfanylpropanoyloxy]ethyl 2,2-dimethylbutanoate;N-ethyl-4-(2-methylbutan-2-yl)benzamide;1-methoxy-4-(2-methylbutan-2-yl)benzene;2-methylbutan-2-ylbenzene;1-(2-methylbutan-2-yl)-4-[(2-methylpropan-2-yl)oxy]benzene;bis([4-(2-methylbutan-2-yl)phenyl] acetate);bis(1-methyl-4-(2-methylbutan-2-yl)benzene);methyl 4-(2-methylbutan-2-yl)benzoate
SMILESCCC(C)(C)c1ccc(C(=O)OC)cc1.CCC(C)(C)c1ccc(C)cc1.CCC(C)(C)c1ccc(C)cc1.CCC(C)(C)c1ccc(OC(C)(C)C)cc1.CCC(C)(C)c1ccc(OC(C)=O)cc1.CCC(C)(C)c1ccc(OC(C)=O)cc1.CCC(C)(C)c1ccc(OC)cc1.CCC(C)(C)c1ccccc1.CCCCC(CC)COC(=O)C(C)(C)CSCCC(=O)OCCOC(=O)C(C)(C)CC.CCCCCCCCCCCCCCCCCCOC(=O)C(C)(C)CSCCC(=O)OCCOC(=O)C(C)(C)CC.CCCCCCCCCCCCCCCCCCOC(=O)C(C)(C)CSCCC(=O)OCCOC(=O)C(C)(C)CC.CCCCCCCCCCCCCCCCCCOC(=O)C(C)(C)CSCCC(=O)OCCOC(=O)C(C)(C)CC.CCCCCCCCCCCCCCCCCCOC(=O)C(C)(C)CSCCC(=O)OCCOC(=O)C(C)(C)CC.CCCCCCCCCCCCOC(=O)C(C)(C)CSCCC(=O)OCCOC(=O)C(C)(C)CC.CCNC(=O)c1ccc(C(C)(C)CC)cc1
InChIInChI=1S/4C34H64O6S.C28H52O6S.C24H44O6S.C15H24O.C14H21NO.3C13H18O2.C12H18O.2C12H18.C11H16/c4*1-7-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-25-39-32(37)34(5,6)29-41-28-24-30(35)38-26-27-40-31(36)33(3,4)8-2;1-7-9-10-11-12-13-14-15-16-17-19-33-26(31)28(5,6)23-35-22-18-24(29)32-20-21-34-25(30)27(3,4)8-2;1-8-11-12-19(9-2)17-30-22(27)24(6,7)18-31-16-13-20(25)28-14-15-29-21(26)23(4,5)10-3;1-7-15(5,6)12-8-10-13(11-9-12)16-14(2,3)4;1-5-14(3,4)12-9-7-11(8-10-12)13(16)15-6-2;1-5-13(2,3)11-8-6-10(7-9-11)12(14)15-4;2*1-5-13(3,4)11-6-8-12(9-7-11)15-10(2)14;1-5-12(2,3)10-6-8-11(13-4)9-7-10;2*1-5-12(3,4)11-8-6-10(2)7-9-11;1-4-11(2,3)10-8-6-5-7-9-10/h4*7-29H2,1-6H3;7-23H2,1-6H3;19H,8-18H2,1-7H3;8-11H,7H2,1-6H3;7-10H,5-6H2,1-4H3,(H,15,16);3*6-9H,5H2,1-4H3;6-9H,5H2,1-4H3;2*6-9H,5H2,1-4H3;5-9H,4H2,1-3H3
InChIKeyIXFXLSYELKHAKF-UHFFFAOYSA-N
MW5090.87 g/mol
LogP81.95
Rot. Bonds176

About tetrakis(2-[3-(2,2-dimethyl-3-octadecoxy-3-oxopropyl)sulfanylpropanoyloxy]ethyl 2,2-dimethylbutanoate);2-[3-(3-dodecoxy-2,2-dimethyl-3-oxopropyl)sulfanylpropanoyloxy]ethyl 2,2-dimethylbutanoate;2-[3-[3-(2-ethylhexoxy)-2,2-dimethyl-3-oxopropyl]sulfanylpropanoyloxy]ethyl 2,2-dimethylbutanoate;N-ethyl-4-(2-methylbutan-2-yl)benzamide;1-methoxy-4-(2-methylbutan-2-yl)benzene;2-methylbutan-2-ylbenzene;1-(2-methylbutan-2-yl)-4-[(2-methylpropan-2-yl)oxy]benzene;bis([4-(2-methylbutan-2-yl)phenyl] acetate);bis(1-methyl-4-(2-methylbutan-2-yl)benzene);methyl 4-(2-methylbutan-2-yl)benzoate

tetrakis(2-[3-(2,2-dimethyl-3-octadecoxy-3-oxopropyl)sulfanylpropanoyloxy]ethyl 2,2-dimethylbutanoate);2-[3-(3-dodecoxy-2,2-dimethyl-3-oxopropyl)sulfanylpropanoyloxy]ethyl 2,2-dimethylbutanoate;2-[3-[3-(2-ethylhexoxy)-2,2-dimethyl-3-oxopropyl]sulfanylpropanoyloxy]ethyl 2,2-dimethylbutanoate;N-ethyl-4-(2-methylbutan-2-yl)benzamide;1-methoxy-4-(2-methylbutan-2-yl)benzene;2-methylbutan-2-ylbenzene;1-(2-methylbutan-2-yl)-4-[(2-methylpropan-2-yl)oxy]benzene;bis([4-(2-methylbutan-2-yl)phenyl] acetate);bis(1-methyl-4-(2-methylbutan-2-yl)benzene);methyl 4-(2-methylbutan-2-yl)benzoate (PubChem CID 158832667) has the molecular formula C303H521NO45S6 and a molecular weight of 5090.87 g/mol. Its IUPAC name is tetrakis(2-[3-(2,2-dimethyl-3-octadecoxy-3-oxopropyl)sulfanylpropanoyloxy]ethyl 2,2-dimethylbutanoate);2-[3-(3-dodecoxy-2,2-dimethyl-3-oxopropyl)sulfanylpropanoyloxy]ethyl 2,2-dimethylbutanoate;2-[3-[3-(2-ethylhexoxy)-2,2-dimethyl-3-oxopropyl]sulfanylpropanoyloxy]ethyl 2,2-dimethylbutanoate;N-ethyl-4-(2-methylbutan-2-yl)benzamide;1-methoxy-4-(2-methylbutan-2-yl)benzene;2-methylbutan-2-ylbenzene;1-(2-methylbutan-2-yl)-4-[(2-methylpropan-2-yl)oxy]benzene;bis([4-(2-methylbutan-2-yl)phenyl] acetate);bis(1-methyl-4-(2-methylbutan-2-yl)benzene);methyl 4-(2-methylbutan-2-yl)benzoate.

Molecular Properties

Compound Nametetrakis(2-[3-(2,2-dimethyl-3-octadecoxy-3-oxopropyl)sulfanylpropanoyloxy]ethyl 2,2-dimethylbutanoate);2-[3-(3-dodecoxy-2,2-dimethyl-3-oxopropyl)sulfanylpropanoyloxy]ethyl 2,2-dimethylbutanoate;2-[3-[3-(2-ethylhexoxy)-2,2-dimethyl-3-oxopropyl]sulfanylpropanoyloxy]ethyl 2,2-dimethylbutanoate;N-ethyl-4-(2-methylbutan-2-yl)benzamide;1-methoxy-4-(2-methylbutan-2-yl)benzene;2-methylbutan-2-ylbenzene;1-(2-methylbutan-2-yl)-4-[(2-methylpropan-2-yl)oxy]benzene;bis([4-(2-methylbutan-2-yl)phenyl] acetate);bis(1-methyl-4-(2-methylbutan-2-yl)benzene);methyl 4-(2-methylbutan-2-yl)benzoate
PubChem CID158832667
Molecular FormulaC303H521NO45S6
Molecular Weight5090.87 g/mol
Exact Mass5086.68
IUPAC Nametetrakis(2-[3-(2,2-dimethyl-3-octadecoxy-3-oxopropyl)sulfanylpropanoyloxy]ethyl 2,2-dimethylbutanoate);2-[3-(3-dodecoxy-2,2-dimethyl-3-oxopropyl)sulfanylpropanoyloxy]ethyl 2,2-dimethylbutanoate;2-[3-[3-(2-ethylhexoxy)-2,2-dimethyl-3-oxopropyl]sulfanylpropanoyloxy]ethyl 2,2-dimethylbutanoate;N-ethyl-4-(2-methylbutan-2-yl)benzamide;1-methoxy-4-(2-methylbutan-2-yl)benzene;2-methylbutan-2-ylbenzene;1-(2-methylbutan-2-yl)-4-[(2-methylpropan-2-yl)oxy]benzene;bis([4-(2-methylbutan-2-yl)phenyl] acetate);bis(1-methyl-4-(2-methylbutan-2-yl)benzene);methyl 4-(2-methylbutan-2-yl)benzoate
SMILESCCC(C)(C)c1ccc(C(=O)OC)cc1.CCC(C)(C)c1ccc(C)cc1.CCC(C)(C)c1ccc(C)cc1.CCC(C)(C)c1ccc(OC(C)(C)C)cc1.CCC(C)(C)c1ccc(OC(C)=O)cc1.CCC(C)(C)c1ccc(OC(C)=O)cc1.CCC(C)(C)c1ccc(OC)cc1.CCC(C)(C)c1ccccc1.CCCCC(CC)COC(=O)C(C)(C)CSCCC(=O)OCCOC(=O)C(C)(C)CC.CCCCCCCCCCCCCCCCCCOC(=O)C(C)(C)CSCCC(=O)OCCOC(=O)C(C)(C)CC.CCCCCCCCCCCCCCCCCCOC(=O)C(C)(C)CSCCC(=O)OCCOC(=O)C(C)(C)CC.CCCCCCCCCCCCCCCCCCOC(=O)C(C)(C)CSCCC(=O)OCCOC(=O)C(C)(C)CC.CCCCCCCCCCCCCCCCCCOC(=O)C(C)(C)CSCCC(=O)OCCOC(=O)C(C)(C)CC.CCCCCCCCCCCCOC(=O)C(C)(C)CSCCC(=O)OCCOC(=O)C(C)(C)CC.CCNC(=O)c1ccc(C(C)(C)CC)cc1
InChIInChI=1S/4C34H64O6S.C28H52O6S.C24H44O6S.C15H24O.C14H21NO.3C13H18O2.C12H18O.2C12H18.C11H16/c4*1-7-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-25-39-32(37)34(5,6)29-41-28-24-30(35)38-26-27-40-31(36)33(3,4)8-2;1-7-9-10-11-12-13-14-15-16-17-19-33-26(31)28(5,6)23-35-22-18-24(29)32-20-21-34-25(30)27(3,4)8-2;1-8-11-12-19(9-2)17-30-22(27)24(6,7)18-31-16-13-20(25)28-14-15-29-21(26)23(4,5)10-3;1-7-15(5,6)12-8-10-13(11-9-12)16-14(2,3)4;1-5-14(3,4)12-9-7-11(8-10-12)13(16)15-6-2;1-5-13(2,3)11-8-6-10(7-9-11)12(14)15-4;2*1-5-13(3,4)11-6-8-12(9-7-11)15-10(2)14;1-5-12(2,3)10-6-8-11(13-4)9-7-10;2*1-5-12(3,4)11-8-6-10(2)7-9-11;1-4-11(2,3)10-8-6-5-7-9-10/h4*7-29H2,1-6H3;7-23H2,1-6H3;19H,8-18H2,1-7H3;8-11H,7H2,1-6H3;7-10H,5-6H2,1-4H3,(H,15,16);3*6-9H,5H2,1-4H3;6-9H,5H2,1-4H3;2*6-9H,5H2,1-4H3;5-9H,4H2,1-3H3
InChIKeyIXFXLSYELKHAKF-UHFFFAOYSA-N
XLogP81.95
TPSA599.86 Ų
H-Bond Donors1
H-Bond Acceptors51
Rotatable Bonds176
Heavy Atoms355
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5005090.87
LogP ≤ 581.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 1051

Analyze tetrakis(2-[3-(2,2-dimethyl-3-octadecoxy-3-oxopropyl)sulfanylpropanoyloxy]ethyl 2,2-dimethylbutanoate);2-[3-(3-dodecoxy-2,2-dimethyl-3-oxopropyl)sulfanylpropanoyloxy]ethyl 2,2-dimethylbutanoate;2-[3-[3-(2-ethylhexoxy)-2,2-dimethyl-3-oxopropyl]sulfanylpropanoyloxy]ethyl 2,2-dimethylbutanoate;N-ethyl-4-(2-methylbutan-2-yl)benzamide;1-methoxy-4-(2-methylbutan-2-yl)benzene;2-methylbutan-2-ylbenzene;1-(2-methylbutan-2-yl)-4-[(2-methylpropan-2-yl)oxy]benzene;bis([4-(2-methylbutan-2-yl)phenyl] acetate);bis(1-methyl-4-(2-methylbutan-2-yl)benzene);methyl 4-(2-methylbutan-2-yl)benzoate with MolForge

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Related Compounds

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(2R)-2-[[3-[[[4-(1-adamantyl)benzoyl]amino]methyl]-4-propoxyphenyl]methyl]-4-phenylbutanoic acid
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N-[2-[2-[2-[2-[2-(2-benzamidoethylsulfanyl)ethoxy]phenyl]phenoxy]ethylsulfanyl]ethyl]benzamide
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[5-(6-Amino-5,5-dimethylhexoxy)-4-ethyl-2-(4-fluorophenyl)phenyl] 4-[[[2-oxo-2-(2-tritylsulfanylethylamino)ethyl]-(2-tritylsulfanylethyl)amino]methyl]benzoate
CID 54241370
Bis[[4-[6-(4-tritylphenoxy)hexoxy]phenyl]methyl]azanium;(12,19-dioxo-2,5,8,11,20,23,26,29-octaoxa-14,17-dithiatricyclo[28.8.0.032,37]octatriaconta-1(38),30,32,34,36-pentaen-15-yl)methyl 4-methylbenzoate
CID 139251876
Bis[[4-[3-[2-[3-[4-[tris(4-tert-butylphenyl)methyl]phenoxy]propylsulfanyl]acetyl]oxypropoxy]phenyl]methyl]azanium;2,5,8,11,18,21,24,27-octaoxatricyclo[26.4.0.012,17]dotriaconta-1(32),12,14,16,28,30-hexaene
CID 139251879
N-[4-(dimethylamino)butyl]-4-[4-(2-phenoxyethylsulfanylmethyl)phenyl]benzamide;oxalic acid
CID 9985088
N-[[3-[4-[(2,4-dioxo-1,3-thiazolidin-5-yl)methyl]phenyl]phenyl]methyl]-N-methyl-4-(4-propoxyphenyl)benzamide
CID 9985373
Methyl 2-[4-[4-[[3-[4-[(2,4-dioxo-1,3-thiazolidin-5-yl)methyl]phenyl]phenyl]methyl-methylcarbamoyl]phenyl]phenoxy]acetate
CID 10077218
N-[[3-[4-[(2,4-dioxo-1,3-thiazolidin-5-yl)methyl]phenyl]phenyl]methyl]-4-(4-hexoxyphenyl)-N-methylbenzamide
CID 10077426
[4-[4-[[3-[4-[(2,4-Dioxo-1,3-thiazolidin-5-yl)methyl]phenyl]phenyl]methyl-methylcarbamoyl]phenyl]phenyl] acetate
CID 10099432
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CID 10393435

Frequently Asked Questions

What is the IUPAC name of tetrakis(2-[3-(2,2-dimethyl-3-octadecoxy-3-oxopropyl)sulfanylpropanoyloxy]ethyl 2,2-dimethylbutanoate);2-[3-(3-dodecoxy-2,2-dimethyl-3-oxopropyl)sulfanylpropanoyloxy]ethyl 2,2-dimethylbutanoate;2-[3-[3-(2-ethylhexoxy)-2,2-dimethyl-3-oxopropyl]sulfanylpropanoyloxy]ethyl 2,2-dimethylbutanoate;N-ethyl-4-(2-methylbutan-2-yl)benzamide;1-methoxy-4-(2-methylbutan-2-yl)benzene;2-methylbutan-2-ylbenzene;1-(2-methylbutan-2-yl)-4-[(2-methylpropan-2-yl)oxy]benzene;bis([4-(2-methylbutan-2-yl)phenyl] acetate);bis(1-methyl-4-(2-methylbutan-2-yl)benzene);methyl 4-(2-methylbutan-2-yl)benzoate?
The IUPAC name of tetrakis(2-[3-(2,2-dimethyl-3-octadecoxy-3-oxopropyl)sulfanylpropanoyloxy]ethyl 2,2-dimethylbutanoate);2-[3-(3-dodecoxy-2,2-dimethyl-3-oxopropyl)sulfanylpropanoyloxy]ethyl 2,2-dimethylbutanoate;2-[3-[3-(2-ethylhexoxy)-2,2-dimethyl-3-oxopropyl]sulfanylpropanoyloxy]ethyl 2,2-dimethylbutanoate;N-ethyl-4-(2-methylbutan-2-yl)benzamide;1-methoxy-4-(2-methylbutan-2-yl)benzene;2-methylbutan-2-ylbenzene;1-(2-methylbutan-2-yl)-4-[(2-methylpropan-2-yl)oxy]benzene;bis([4-(2-methylbutan-2-yl)phenyl] acetate);bis(1-methyl-4-(2-methylbutan-2-yl)benzene);methyl 4-(2-methylbutan-2-yl)benzoate (CID 158832667) is tetrakis(2-[3-(2,2-dimethyl-3-octadecoxy-3-oxopropyl)sulfanylpropanoyloxy]ethyl 2,2-dimethylbutanoate);2-[3-(3-dodecoxy-2,2-dimethyl-3-oxopropyl)sulfanylpropanoyloxy]ethyl 2,2-dimethylbutanoate;2-[3-[3-(2-ethylhexoxy)-2,2-dimethyl-3-oxopropyl]sulfanylpropanoyloxy]ethyl 2,2-dimethylbutanoate;N-ethyl-4-(2-methylbutan-2-yl)benzamide;1-methoxy-4-(2-methylbutan-2-yl)benzene;2-methylbutan-2-ylbenzene;1-(2-methylbutan-2-yl)-4-[(2-methylpropan-2-yl)oxy]benzene;bis([4-(2-methylbutan-2-yl)phenyl] acetate);bis(1-methyl-4-(2-methylbutan-2-yl)benzene);methyl 4-(2-methylbutan-2-yl)benzoate.
What is the SMILES notation for tetrakis(2-[3-(2,2-dimethyl-3-octadecoxy-3-oxopropyl)sulfanylpropanoyloxy]ethyl 2,2-dimethylbutanoate);2-[3-(3-dodecoxy-2,2-dimethyl-3-oxopropyl)sulfanylpropanoyloxy]ethyl 2,2-dimethylbutanoate;2-[3-[3-(2-ethylhexoxy)-2,2-dimethyl-3-oxopropyl]sulfanylpropanoyloxy]ethyl 2,2-dimethylbutanoate;N-ethyl-4-(2-methylbutan-2-yl)benzamide;1-methoxy-4-(2-methylbutan-2-yl)benzene;2-methylbutan-2-ylbenzene;1-(2-methylbutan-2-yl)-4-[(2-methylpropan-2-yl)oxy]benzene;bis([4-(2-methylbutan-2-yl)phenyl] acetate);bis(1-methyl-4-(2-methylbutan-2-yl)benzene);methyl 4-(2-methylbutan-2-yl)benzoate?
The canonical SMILES for tetrakis(2-[3-(2,2-dimethyl-3-octadecoxy-3-oxopropyl)sulfanylpropanoyloxy]ethyl 2,2-dimethylbutanoate);2-[3-(3-dodecoxy-2,2-dimethyl-3-oxopropyl)sulfanylpropanoyloxy]ethyl 2,2-dimethylbutanoate;2-[3-[3-(2-ethylhexoxy)-2,2-dimethyl-3-oxopropyl]sulfanylpropanoyloxy]ethyl 2,2-dimethylbutanoate;N-ethyl-4-(2-methylbutan-2-yl)benzamide;1-methoxy-4-(2-methylbutan-2-yl)benzene;2-methylbutan-2-ylbenzene;1-(2-methylbutan-2-yl)-4-[(2-methylpropan-2-yl)oxy]benzene;bis([4-(2-methylbutan-2-yl)phenyl] acetate);bis(1-methyl-4-(2-methylbutan-2-yl)benzene);methyl 4-(2-methylbutan-2-yl)benzoate is CCC(C)(C)c1ccc(C(=O)OC)cc1.CCC(C)(C)c1ccc(C)cc1.CCC(C)(C)c1ccc(C)cc1.CCC(C)(C)c1ccc(OC(C)(C)C)cc1.CCC(C)(C)c1ccc(OC(C)=O)cc1.CCC(C)(C)c1ccc(OC(C)=O)cc1.CCC(C)(C)c1ccc(OC)cc1.CCC(C)(C)c1ccccc1.CCCCC(CC)COC(=O)C(C)(C)CSCCC(=O)OCCOC(=O)C(C)(C)CC.CCCCCCCCCCCCCCCCCCOC(=O)C(C)(C)CSCCC(=O)OCCOC(=O)C(C)(C)CC.CCCCCCCCCCCCCCCCCCOC(=O)C(C)(C)CSCCC(=O)OCCOC(=O)C(C)(C)CC.CCCCCCCCCCCCCCCCCCOC(=O)C(C)(C)CSCCC(=O)OCCOC(=O)C(C)(C)CC.CCCCCCCCCCCCCCCCCCOC(=O)C(C)(C)CSCCC(=O)OCCOC(=O)C(C)(C)CC.CCCCCCCCCCCCOC(=O)C(C)(C)CSCCC(=O)OCCOC(=O)C(C)(C)CC.CCNC(=O)c1ccc(C(C)(C)CC)cc1.
What is the InChIKey of tetrakis(2-[3-(2,2-dimethyl-3-octadecoxy-3-oxopropyl)sulfanylpropanoyloxy]ethyl 2,2-dimethylbutanoate);2-[3-(3-dodecoxy-2,2-dimethyl-3-oxopropyl)sulfanylpropanoyloxy]ethyl 2,2-dimethylbutanoate;2-[3-[3-(2-ethylhexoxy)-2,2-dimethyl-3-oxopropyl]sulfanylpropanoyloxy]ethyl 2,2-dimethylbutanoate;N-ethyl-4-(2-methylbutan-2-yl)benzamide;1-methoxy-4-(2-methylbutan-2-yl)benzene;2-methylbutan-2-ylbenzene;1-(2-methylbutan-2-yl)-4-[(2-methylpropan-2-yl)oxy]benzene;bis([4-(2-methylbutan-2-yl)phenyl] acetate);bis(1-methyl-4-(2-methylbutan-2-yl)benzene);methyl 4-(2-methylbutan-2-yl)benzoate?
The InChIKey is IXFXLSYELKHAKF-UHFFFAOYSA-N. The full InChI is InChI=1S/4C34H64O6S.C28H52O6S.C24H44O6S.C15H24O.C14H21NO.3C13H18O2.C12H18O.2C12H18.C11H16/c4*1-7-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-25-39-32(37)34(5,6)29-41-28-24-30(35)38-26-27-40-31(36)33(3,4)8-2;1-7-9-10-11-12-13-14-15-16-17-19-33-26(31)28(5,6)23-35-22-18-24(29)32-20-21-34-25(30)27(3,4)8-2;1-8-11-12-19(9-2)17-30-22(27)24(6,7)18-31-16-13-20(25)28-14-15-29-21(26)23(4,5)10-3;1-7-15(5,6)12-8-10-13(11-9-12)16-14(2,3)4;1-5-14(3,4)12-9-7-11(8-10-12)13(16)15-6-2;1-5-13(2,3)11-8-6-10(7-9-11)12(14)15-4;2*1-5-13(3,4)11-6-8-12(9-7-11)15-10(2)14;1-5-12(2,3)10-6-8-11(13-4)9-7-10;2*1-5-12(3,4)11-8-6-10(2)7-9-11;1-4-11(2,3)10-8-6-5-7-9-10/h4*7-29H2,1-6H3;7-23H2,1-6H3;19H,8-18H2,1-7H3;8-11H,7H2,1-6H3;7-10H,5-6H2,1-4H3,(H,15,16);3*6-9H,5H2,1-4H3;6-9H,5H2,1-4H3;2*6-9H,5H2,1-4H3;5-9H,4H2,1-3H3.
What are the key properties of tetrakis(2-[3-(2,2-dimethyl-3-octadecoxy-3-oxopropyl)sulfanylpropanoyloxy]ethyl 2,2-dimethylbutanoate);2-[3-(3-dodecoxy-2,2-dimethyl-3-oxopropyl)sulfanylpropanoyloxy]ethyl 2,2-dimethylbutanoate;2-[3-[3-(2-ethylhexoxy)-2,2-dimethyl-3-oxopropyl]sulfanylpropanoyloxy]ethyl 2,2-dimethylbutanoate;N-ethyl-4-(2-methylbutan-2-yl)benzamide;1-methoxy-4-(2-methylbutan-2-yl)benzene;2-methylbutan-2-ylbenzene;1-(2-methylbutan-2-yl)-4-[(2-methylpropan-2-yl)oxy]benzene;bis([4-(2-methylbutan-2-yl)phenyl] acetate);bis(1-methyl-4-(2-methylbutan-2-yl)benzene);methyl 4-(2-methylbutan-2-yl)benzoate?
tetrakis(2-[3-(2,2-dimethyl-3-octadecoxy-3-oxopropyl)sulfanylpropanoyloxy]ethyl 2,2-dimethylbutanoate);2-[3-(3-dodecoxy-2,2-dimethyl-3-oxopropyl)sulfanylpropanoyloxy]ethyl 2,2-dimethylbutanoate;2-[3-[3-(2-ethylhexoxy)-2,2-dimethyl-3-oxopropyl]sulfanylpropanoyloxy]ethyl 2,2-dimethylbutanoate;N-ethyl-4-(2-methylbutan-2-yl)benzamide;1-methoxy-4-(2-methylbutan-2-yl)benzene;2-methylbutan-2-ylbenzene;1-(2-methylbutan-2-yl)-4-[(2-methylpropan-2-yl)oxy]benzene;bis([4-(2-methylbutan-2-yl)phenyl] acetate);bis(1-methyl-4-(2-methylbutan-2-yl)benzene);methyl 4-(2-methylbutan-2-yl)benzoate has a molecular weight of 5090.87 g/mol, XLogP of 81.95, 176 rotatable bonds, 1 hydrogen bond donors, and 51 hydrogen bond acceptors.
Where does this data come from?
All data for tetrakis(2-[3-(2,2-dimethyl-3-octadecoxy-3-oxopropyl)sulfanylpropanoyloxy]ethyl 2,2-dimethylbutanoate);2-[3-(3-dodecoxy-2,2-dimethyl-3-oxopropyl)sulfanylpropanoyloxy]ethyl 2,2-dimethylbutanoate;2-[3-[3-(2-ethylhexoxy)-2,2-dimethyl-3-oxopropyl]sulfanylpropanoyloxy]ethyl 2,2-dimethylbutanoate;N-ethyl-4-(2-methylbutan-2-yl)benzamide;1-methoxy-4-(2-methylbutan-2-yl)benzene;2-methylbutan-2-ylbenzene;1-(2-methylbutan-2-yl)-4-[(2-methylpropan-2-yl)oxy]benzene;bis([4-(2-methylbutan-2-yl)phenyl] acetate);bis(1-methyl-4-(2-methylbutan-2-yl)benzene);methyl 4-(2-methylbutan-2-yl)benzoate is sourced from PubChem (CID 158832667), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).