1,3-bis[(2-methylpropan-2-yl)oxy]-2,2-bis[(2-methylpropan-2-yl)oxymethyl]propane;2-[2,3-bis[(2-methylpropan-2-yl)oxy]propoxy]-2-methylpropane;2-[3-[2,3-bis[(2-methylpropan-2-yl)oxy]propoxy]-2-[(2-methylpropan-2-yl)oxy]propoxy]-2-methylpropane;2-[3-[3-[2,3-bis[(2-methylpropan-2-yl)oxy]propoxy]-2-[(2-methylpropan-2-yl)oxy]propoxy]-2-[(2-methylpropan-2-yl)oxy]propoxy]-2-methylpropane;1,2,3,4,5,6-hexakis[(2-methylpropan-2-yl)oxy]hexane;1,2,3,4,5-pentakis[(2-methylpropan-2-yl)oxy]pentane;1,2,3,4-tetrakis[(2-methylpropan-2-yl)oxy]butane

C162H338O34 — CID 158588101

IUPAC1,3-bis[(2-methylpropan-2-yl)oxy]-2,2-bis[(2-methylpropan-2-yl)oxymethyl]propane;2-[2,3-bis[(2-methylpropan-2-yl)oxy]propoxy]-2-methylpropane;2-[3-[2,3-bis[(2-methylpropan-2-yl)oxy]propoxy]-2-[(2-methylpropan-2-yl)oxy]propoxy]-2-methylpropane;2-[3-[3-[2,3-bis[(2-methylpropan-2-yl)oxy]propoxy]-2-[(2-methylpropan-2-yl)oxy]propoxy]-2-[(2-methylpropan-2-yl)oxy]propoxy]-2-methylpropane;1,2,3,4,5,6-hexakis[(2-methylpropan-2-yl)oxy]hexane;1,2,3,4,5-pentakis[(2-methylpropan-2-yl)oxy]pentane;1,2,3,4-tetrakis[(2-methylpropan-2-yl)oxy]butane
SMILESCC(C)(C)OCC(COC(C)(C)C)(COC(C)(C)C)COC(C)(C)C.CC(C)(C)OCC(COC(C)(C)C)OC(C)(C)C.CC(C)(C)OCC(COCC(COC(C)(C)C)OC(C)(C)C)OC(C)(C)C.CC(C)(C)OCC(COCC(COCC(COC(C)(C)C)OC(C)(C)C)OC(C)(C)C)OC(C)(C)C.CC(C)(C)OCC(OC(C)(C)C)C(COC(C)(C)C)OC(C)(C)C.CC(C)(C)OCC(OC(C)(C)C)C(OC(C)(C)C)C(COC(C)(C)C)OC(C)(C)C.CC(C)(C)OCC(OC(C)(C)C)C(OC(C)(C)C)C(OC(C)(C)C)C(COC(C)(C)C)OC(C)(C)C
InChIInChI=1S/C30H62O6.C29H60O7.C25H52O5.C22H46O5.C21H44O4.C20H42O4.C15H32O3/c1-25(2,3)31-19-21(33-27(7,8)9)23(35-29(13,14)15)24(36-30(16,17)18)22(34-28(10,11)12)20-32-26(4,5)6;1-25(2,3)32-20-23(35-28(10,11)12)18-30-16-22(34-27(7,8)9)17-31-19-24(36-29(13,14)15)21-33-26(4,5)6;1-21(2,3)26-16-18(28-23(7,8)9)20(30-25(13,14)15)19(29-24(10,11)12)17-27-22(4,5)6;1-19(2,3)24-15-17(26-21(7,8)9)13-23-14-18(27-22(10,11)12)16-25-20(4,5)6;1-17(2,3)22-13-21(14-23-18(4,5)6,15-24-19(7,8)9)16-25-20(10,11)12;1-17(2,3)21-13-15(23-19(7,8)9)16(24-20(10,11)12)14-22-18(4,5)6;1-13(2,3)16-10-12(18-15(7,8)9)11-17-14(4,5)6/h21-24H,19-20H2,1-18H3;22-24H,16-21H2,1-15H3;18-20H,16-17H2,1-15H3;17-18H,13-16H2,1-12H3;13-16H2,1-12H3;15-16H,13-14H2,1-12H3;12H,10-11H2,1-9H3
InChIKeyHUBWPJSXEZUVTG-UHFFFAOYSA-N
MW2830.45 g/mol
LogP38.74
Rot. Bonds65

About 1,3-bis[(2-methylpropan-2-yl)oxy]-2,2-bis[(2-methylpropan-2-yl)oxymethyl]propane;2-[2,3-bis[(2-methylpropan-2-yl)oxy]propoxy]-2-methylpropane;2-[3-[2,3-bis[(2-methylpropan-2-yl)oxy]propoxy]-2-[(2-methylpropan-2-yl)oxy]propoxy]-2-methylpropane;2-[3-[3-[2,3-bis[(2-methylpropan-2-yl)oxy]propoxy]-2-[(2-methylpropan-2-yl)oxy]propoxy]-2-[(2-methylpropan-2-yl)oxy]propoxy]-2-methylpropane;1,2,3,4,5,6-hexakis[(2-methylpropan-2-yl)oxy]hexane;1,2,3,4,5-pentakis[(2-methylpropan-2-yl)oxy]pentane;1,2,3,4-tetrakis[(2-methylpropan-2-yl)oxy]butane

1,3-bis[(2-methylpropan-2-yl)oxy]-2,2-bis[(2-methylpropan-2-yl)oxymethyl]propane;2-[2,3-bis[(2-methylpropan-2-yl)oxy]propoxy]-2-methylpropane;2-[3-[2,3-bis[(2-methylpropan-2-yl)oxy]propoxy]-2-[(2-methylpropan-2-yl)oxy]propoxy]-2-methylpropane;2-[3-[3-[2,3-bis[(2-methylpropan-2-yl)oxy]propoxy]-2-[(2-methylpropan-2-yl)oxy]propoxy]-2-[(2-methylpropan-2-yl)oxy]propoxy]-2-methylpropane;1,2,3,4,5,6-hexakis[(2-methylpropan-2-yl)oxy]hexane;1,2,3,4,5-pentakis[(2-methylpropan-2-yl)oxy]pentane;1,2,3,4-tetrakis[(2-methylpropan-2-yl)oxy]butane (PubChem CID 158588101) has the molecular formula C162H338O34 and a molecular weight of 2830.45 g/mol. Its IUPAC name is 1,3-bis[(2-methylpropan-2-yl)oxy]-2,2-bis[(2-methylpropan-2-yl)oxymethyl]propane;2-[2,3-bis[(2-methylpropan-2-yl)oxy]propoxy]-2-methylpropane;2-[3-[2,3-bis[(2-methylpropan-2-yl)oxy]propoxy]-2-[(2-methylpropan-2-yl)oxy]propoxy]-2-methylpropane;2-[3-[3-[2,3-bis[(2-methylpropan-2-yl)oxy]propoxy]-2-[(2-methylpropan-2-yl)oxy]propoxy]-2-[(2-methylpropan-2-yl)oxy]propoxy]-2-methylpropane;1,2,3,4,5,6-hexakis[(2-methylpropan-2-yl)oxy]hexane;1,2,3,4,5-pentakis[(2-methylpropan-2-yl)oxy]pentane;1,2,3,4-tetrakis[(2-methylpropan-2-yl)oxy]butane.

Molecular Properties

Compound Name1,3-bis[(2-methylpropan-2-yl)oxy]-2,2-bis[(2-methylpropan-2-yl)oxymethyl]propane;2-[2,3-bis[(2-methylpropan-2-yl)oxy]propoxy]-2-methylpropane;2-[3-[2,3-bis[(2-methylpropan-2-yl)oxy]propoxy]-2-[(2-methylpropan-2-yl)oxy]propoxy]-2-methylpropane;2-[3-[3-[2,3-bis[(2-methylpropan-2-yl)oxy]propoxy]-2-[(2-methylpropan-2-yl)oxy]propoxy]-2-[(2-methylpropan-2-yl)oxy]propoxy]-2-methylpropane;1,2,3,4,5,6-hexakis[(2-methylpropan-2-yl)oxy]hexane;1,2,3,4,5-pentakis[(2-methylpropan-2-yl)oxy]pentane;1,2,3,4-tetrakis[(2-methylpropan-2-yl)oxy]butane
PubChem CID158588101
Molecular FormulaC162H338O34
Molecular Weight2830.45 g/mol
Exact Mass2828.47
IUPAC Name1,3-bis[(2-methylpropan-2-yl)oxy]-2,2-bis[(2-methylpropan-2-yl)oxymethyl]propane;2-[2,3-bis[(2-methylpropan-2-yl)oxy]propoxy]-2-methylpropane;2-[3-[2,3-bis[(2-methylpropan-2-yl)oxy]propoxy]-2-[(2-methylpropan-2-yl)oxy]propoxy]-2-methylpropane;2-[3-[3-[2,3-bis[(2-methylpropan-2-yl)oxy]propoxy]-2-[(2-methylpropan-2-yl)oxy]propoxy]-2-[(2-methylpropan-2-yl)oxy]propoxy]-2-methylpropane;1,2,3,4,5,6-hexakis[(2-methylpropan-2-yl)oxy]hexane;1,2,3,4,5-pentakis[(2-methylpropan-2-yl)oxy]pentane;1,2,3,4-tetrakis[(2-methylpropan-2-yl)oxy]butane
SMILESCC(C)(C)OCC(COC(C)(C)C)(COC(C)(C)C)COC(C)(C)C.CC(C)(C)OCC(COC(C)(C)C)OC(C)(C)C.CC(C)(C)OCC(COCC(COC(C)(C)C)OC(C)(C)C)OC(C)(C)C.CC(C)(C)OCC(COCC(COCC(COC(C)(C)C)OC(C)(C)C)OC(C)(C)C)OC(C)(C)C.CC(C)(C)OCC(OC(C)(C)C)C(COC(C)(C)C)OC(C)(C)C.CC(C)(C)OCC(OC(C)(C)C)C(OC(C)(C)C)C(COC(C)(C)C)OC(C)(C)C.CC(C)(C)OCC(OC(C)(C)C)C(OC(C)(C)C)C(OC(C)(C)C)C(COC(C)(C)C)OC(C)(C)C
InChIInChI=1S/C30H62O6.C29H60O7.C25H52O5.C22H46O5.C21H44O4.C20H42O4.C15H32O3/c1-25(2,3)31-19-21(33-27(7,8)9)23(35-29(13,14)15)24(36-30(16,17)18)22(34-28(10,11)12)20-32-26(4,5)6;1-25(2,3)32-20-23(35-28(10,11)12)18-30-16-22(34-27(7,8)9)17-31-19-24(36-29(13,14)15)21-33-26(4,5)6;1-21(2,3)26-16-18(28-23(7,8)9)20(30-25(13,14)15)19(29-24(10,11)12)17-27-22(4,5)6;1-19(2,3)24-15-17(26-21(7,8)9)13-23-14-18(27-22(10,11)12)16-25-20(4,5)6;1-17(2,3)22-13-21(14-23-18(4,5)6,15-24-19(7,8)9)16-25-20(10,11)12;1-17(2,3)21-13-15(23-19(7,8)9)16(24-20(10,11)12)14-22-18(4,5)6;1-13(2,3)16-10-12(18-15(7,8)9)11-17-14(4,5)6/h21-24H,19-20H2,1-18H3;22-24H,16-21H2,1-15H3;18-20H,16-17H2,1-15H3;17-18H,13-16H2,1-12H3;13-16H2,1-12H3;15-16H,13-14H2,1-12H3;12H,10-11H2,1-9H3
InChIKeyHUBWPJSXEZUVTG-UHFFFAOYSA-N
XLogP38.74
TPSA313.82 Ų
H-Bond Donors
H-Bond Acceptors34
Rotatable Bonds65
Heavy Atoms196
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002830.45
LogP ≤ 538.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1034

Analyze 1,3-bis[(2-methylpropan-2-yl)oxy]-2,2-bis[(2-methylpropan-2-yl)oxymethyl]propane;2-[2,3-bis[(2-methylpropan-2-yl)oxy]propoxy]-2-methylpropane;2-[3-[2,3-bis[(2-methylpropan-2-yl)oxy]propoxy]-2-[(2-methylpropan-2-yl)oxy]propoxy]-2-methylpropane;2-[3-[3-[2,3-bis[(2-methylpropan-2-yl)oxy]propoxy]-2-[(2-methylpropan-2-yl)oxy]propoxy]-2-[(2-methylpropan-2-yl)oxy]propoxy]-2-methylpropane;1,2,3,4,5,6-hexakis[(2-methylpropan-2-yl)oxy]hexane;1,2,3,4,5-pentakis[(2-methylpropan-2-yl)oxy]pentane;1,2,3,4-tetrakis[(2-methylpropan-2-yl)oxy]butane with MolForge

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Frequently Asked Questions

What is the IUPAC name of 1,3-bis[(2-methylpropan-2-yl)oxy]-2,2-bis[(2-methylpropan-2-yl)oxymethyl]propane;2-[2,3-bis[(2-methylpropan-2-yl)oxy]propoxy]-2-methylpropane;2-[3-[2,3-bis[(2-methylpropan-2-yl)oxy]propoxy]-2-[(2-methylpropan-2-yl)oxy]propoxy]-2-methylpropane;2-[3-[3-[2,3-bis[(2-methylpropan-2-yl)oxy]propoxy]-2-[(2-methylpropan-2-yl)oxy]propoxy]-2-[(2-methylpropan-2-yl)oxy]propoxy]-2-methylpropane;1,2,3,4,5,6-hexakis[(2-methylpropan-2-yl)oxy]hexane;1,2,3,4,5-pentakis[(2-methylpropan-2-yl)oxy]pentane;1,2,3,4-tetrakis[(2-methylpropan-2-yl)oxy]butane?
The IUPAC name of 1,3-bis[(2-methylpropan-2-yl)oxy]-2,2-bis[(2-methylpropan-2-yl)oxymethyl]propane;2-[2,3-bis[(2-methylpropan-2-yl)oxy]propoxy]-2-methylpropane;2-[3-[2,3-bis[(2-methylpropan-2-yl)oxy]propoxy]-2-[(2-methylpropan-2-yl)oxy]propoxy]-2-methylpropane;2-[3-[3-[2,3-bis[(2-methylpropan-2-yl)oxy]propoxy]-2-[(2-methylpropan-2-yl)oxy]propoxy]-2-[(2-methylpropan-2-yl)oxy]propoxy]-2-methylpropane;1,2,3,4,5,6-hexakis[(2-methylpropan-2-yl)oxy]hexane;1,2,3,4,5-pentakis[(2-methylpropan-2-yl)oxy]pentane;1,2,3,4-tetrakis[(2-methylpropan-2-yl)oxy]butane (CID 158588101) is 1,3-bis[(2-methylpropan-2-yl)oxy]-2,2-bis[(2-methylpropan-2-yl)oxymethyl]propane;2-[2,3-bis[(2-methylpropan-2-yl)oxy]propoxy]-2-methylpropane;2-[3-[2,3-bis[(2-methylpropan-2-yl)oxy]propoxy]-2-[(2-methylpropan-2-yl)oxy]propoxy]-2-methylpropane;2-[3-[3-[2,3-bis[(2-methylpropan-2-yl)oxy]propoxy]-2-[(2-methylpropan-2-yl)oxy]propoxy]-2-[(2-methylpropan-2-yl)oxy]propoxy]-2-methylpropane;1,2,3,4,5,6-hexakis[(2-methylpropan-2-yl)oxy]hexane;1,2,3,4,5-pentakis[(2-methylpropan-2-yl)oxy]pentane;1,2,3,4-tetrakis[(2-methylpropan-2-yl)oxy]butane.
What is the SMILES notation for 1,3-bis[(2-methylpropan-2-yl)oxy]-2,2-bis[(2-methylpropan-2-yl)oxymethyl]propane;2-[2,3-bis[(2-methylpropan-2-yl)oxy]propoxy]-2-methylpropane;2-[3-[2,3-bis[(2-methylpropan-2-yl)oxy]propoxy]-2-[(2-methylpropan-2-yl)oxy]propoxy]-2-methylpropane;2-[3-[3-[2,3-bis[(2-methylpropan-2-yl)oxy]propoxy]-2-[(2-methylpropan-2-yl)oxy]propoxy]-2-[(2-methylpropan-2-yl)oxy]propoxy]-2-methylpropane;1,2,3,4,5,6-hexakis[(2-methylpropan-2-yl)oxy]hexane;1,2,3,4,5-pentakis[(2-methylpropan-2-yl)oxy]pentane;1,2,3,4-tetrakis[(2-methylpropan-2-yl)oxy]butane?
The canonical SMILES for 1,3-bis[(2-methylpropan-2-yl)oxy]-2,2-bis[(2-methylpropan-2-yl)oxymethyl]propane;2-[2,3-bis[(2-methylpropan-2-yl)oxy]propoxy]-2-methylpropane;2-[3-[2,3-bis[(2-methylpropan-2-yl)oxy]propoxy]-2-[(2-methylpropan-2-yl)oxy]propoxy]-2-methylpropane;2-[3-[3-[2,3-bis[(2-methylpropan-2-yl)oxy]propoxy]-2-[(2-methylpropan-2-yl)oxy]propoxy]-2-[(2-methylpropan-2-yl)oxy]propoxy]-2-methylpropane;1,2,3,4,5,6-hexakis[(2-methylpropan-2-yl)oxy]hexane;1,2,3,4,5-pentakis[(2-methylpropan-2-yl)oxy]pentane;1,2,3,4-tetrakis[(2-methylpropan-2-yl)oxy]butane is CC(C)(C)OCC(COC(C)(C)C)(COC(C)(C)C)COC(C)(C)C.CC(C)(C)OCC(COC(C)(C)C)OC(C)(C)C.CC(C)(C)OCC(COCC(COC(C)(C)C)OC(C)(C)C)OC(C)(C)C.CC(C)(C)OCC(COCC(COCC(COC(C)(C)C)OC(C)(C)C)OC(C)(C)C)OC(C)(C)C.CC(C)(C)OCC(OC(C)(C)C)C(COC(C)(C)C)OC(C)(C)C.CC(C)(C)OCC(OC(C)(C)C)C(OC(C)(C)C)C(COC(C)(C)C)OC(C)(C)C.CC(C)(C)OCC(OC(C)(C)C)C(OC(C)(C)C)C(OC(C)(C)C)C(COC(C)(C)C)OC(C)(C)C.
What is the InChIKey of 1,3-bis[(2-methylpropan-2-yl)oxy]-2,2-bis[(2-methylpropan-2-yl)oxymethyl]propane;2-[2,3-bis[(2-methylpropan-2-yl)oxy]propoxy]-2-methylpropane;2-[3-[2,3-bis[(2-methylpropan-2-yl)oxy]propoxy]-2-[(2-methylpropan-2-yl)oxy]propoxy]-2-methylpropane;2-[3-[3-[2,3-bis[(2-methylpropan-2-yl)oxy]propoxy]-2-[(2-methylpropan-2-yl)oxy]propoxy]-2-[(2-methylpropan-2-yl)oxy]propoxy]-2-methylpropane;1,2,3,4,5,6-hexakis[(2-methylpropan-2-yl)oxy]hexane;1,2,3,4,5-pentakis[(2-methylpropan-2-yl)oxy]pentane;1,2,3,4-tetrakis[(2-methylpropan-2-yl)oxy]butane?
The InChIKey is HUBWPJSXEZUVTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H62O6.C29H60O7.C25H52O5.C22H46O5.C21H44O4.C20H42O4.C15H32O3/c1-25(2,3)31-19-21(33-27(7,8)9)23(35-29(13,14)15)24(36-30(16,17)18)22(34-28(10,11)12)20-32-26(4,5)6;1-25(2,3)32-20-23(35-28(10,11)12)18-30-16-22(34-27(7,8)9)17-31-19-24(36-29(13,14)15)21-33-26(4,5)6;1-21(2,3)26-16-18(28-23(7,8)9)20(30-25(13,14)15)19(29-24(10,11)12)17-27-22(4,5)6;1-19(2,3)24-15-17(26-21(7,8)9)13-23-14-18(27-22(10,11)12)16-25-20(4,5)6;1-17(2,3)22-13-21(14-23-18(4,5)6,15-24-19(7,8)9)16-25-20(10,11)12;1-17(2,3)21-13-15(23-19(7,8)9)16(24-20(10,11)12)14-22-18(4,5)6;1-13(2,3)16-10-12(18-15(7,8)9)11-17-14(4,5)6/h21-24H,19-20H2,1-18H3;22-24H,16-21H2,1-15H3;18-20H,16-17H2,1-15H3;17-18H,13-16H2,1-12H3;13-16H2,1-12H3;15-16H,13-14H2,1-12H3;12H,10-11H2,1-9H3.
What are the key properties of 1,3-bis[(2-methylpropan-2-yl)oxy]-2,2-bis[(2-methylpropan-2-yl)oxymethyl]propane;2-[2,3-bis[(2-methylpropan-2-yl)oxy]propoxy]-2-methylpropane;2-[3-[2,3-bis[(2-methylpropan-2-yl)oxy]propoxy]-2-[(2-methylpropan-2-yl)oxy]propoxy]-2-methylpropane;2-[3-[3-[2,3-bis[(2-methylpropan-2-yl)oxy]propoxy]-2-[(2-methylpropan-2-yl)oxy]propoxy]-2-[(2-methylpropan-2-yl)oxy]propoxy]-2-methylpropane;1,2,3,4,5,6-hexakis[(2-methylpropan-2-yl)oxy]hexane;1,2,3,4,5-pentakis[(2-methylpropan-2-yl)oxy]pentane;1,2,3,4-tetrakis[(2-methylpropan-2-yl)oxy]butane?
1,3-bis[(2-methylpropan-2-yl)oxy]-2,2-bis[(2-methylpropan-2-yl)oxymethyl]propane;2-[2,3-bis[(2-methylpropan-2-yl)oxy]propoxy]-2-methylpropane;2-[3-[2,3-bis[(2-methylpropan-2-yl)oxy]propoxy]-2-[(2-methylpropan-2-yl)oxy]propoxy]-2-methylpropane;2-[3-[3-[2,3-bis[(2-methylpropan-2-yl)oxy]propoxy]-2-[(2-methylpropan-2-yl)oxy]propoxy]-2-[(2-methylpropan-2-yl)oxy]propoxy]-2-methylpropane;1,2,3,4,5,6-hexakis[(2-methylpropan-2-yl)oxy]hexane;1,2,3,4,5-pentakis[(2-methylpropan-2-yl)oxy]pentane;1,2,3,4-tetrakis[(2-methylpropan-2-yl)oxy]butane has a molecular weight of 2830.45 g/mol, XLogP of 38.74, 65 rotatable bonds, 0 hydrogen bond donors, and 34 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-bis[(2-methylpropan-2-yl)oxy]-2,2-bis[(2-methylpropan-2-yl)oxymethyl]propane;2-[2,3-bis[(2-methylpropan-2-yl)oxy]propoxy]-2-methylpropane;2-[3-[2,3-bis[(2-methylpropan-2-yl)oxy]propoxy]-2-[(2-methylpropan-2-yl)oxy]propoxy]-2-methylpropane;2-[3-[3-[2,3-bis[(2-methylpropan-2-yl)oxy]propoxy]-2-[(2-methylpropan-2-yl)oxy]propoxy]-2-[(2-methylpropan-2-yl)oxy]propoxy]-2-methylpropane;1,2,3,4,5,6-hexakis[(2-methylpropan-2-yl)oxy]hexane;1,2,3,4,5-pentakis[(2-methylpropan-2-yl)oxy]pentane;1,2,3,4-tetrakis[(2-methylpropan-2-yl)oxy]butane is sourced from PubChem (CID 158588101), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).