5-(2-ethoxypropoxy)-2-(2-methoxypropoxy)hexane-1,4-diol

C15H32O6 — CID 57297918

IUPAC5-(2-ethoxypropoxy)-2-(2-methoxypropoxy)hexane-1,4-diol
SMILESCCOC(C)COC(C)C(O)CC(CO)OCC(C)OC
InChIInChI=1S/C15H32O6/c1-6-19-12(3)10-20-13(4)15(17)7-14(8-16)21-9-11(2)18-5/h11-17H,6-10H2,1-5H3
InChIKeyFZXXQRMNUGHNAL-UHFFFAOYSA-N
MW308.42 g/mol
LogP0.98
Rot. Bonds13

About 5-(2-ethoxypropoxy)-2-(2-methoxypropoxy)hexane-1,4-diol

5-(2-ethoxypropoxy)-2-(2-methoxypropoxy)hexane-1,4-diol (PubChem CID 57297918) has the molecular formula C15H32O6 and a molecular weight of 308.42 g/mol. Its IUPAC name is 5-(2-ethoxypropoxy)-2-(2-methoxypropoxy)hexane-1,4-diol.

Molecular Properties

Compound Name5-(2-ethoxypropoxy)-2-(2-methoxypropoxy)hexane-1,4-diol
PubChem CID57297918
Molecular FormulaC15H32O6
Molecular Weight308.42 g/mol
Exact Mass308.22
IUPAC Name5-(2-ethoxypropoxy)-2-(2-methoxypropoxy)hexane-1,4-diol
SMILESCCOC(C)COC(C)C(O)CC(CO)OCC(C)OC
InChIInChI=1S/C15H32O6/c1-6-19-12(3)10-20-13(4)15(17)7-14(8-16)21-9-11(2)18-5/h11-17H,6-10H2,1-5H3
InChIKeyFZXXQRMNUGHNAL-UHFFFAOYSA-N
XLogP0.98
TPSA77.38 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds13
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.42
LogP ≤ 50.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

2-[2-(2-ethoxypropoxy)propoxy]propan-1-ol;2-[2-(2-methoxypropoxy)propoxy]propan-1-ol
CID 160742251
2-[2-[2-[2-[2-[2-[2-[2-(2-methoxypropoxy)propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propan-1-ol
CID 87903083
2-[2-[2-[2-[2-[2-[2-(2-methoxypropoxy)propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propan-1-ol
CID 87899211
1-ethoxy-2-(2-ethoxypropoxy)propane;1-ethoxy-2-(2-methoxypropoxy)propane
CID 159210596
methoxymethane;2-[2-(2-methoxypropoxy)propoxy]propan-1-ol
CID 161462998
2-[2-(2-ethoxypropoxy)propoxy]-1-fluoropropan-1-ol
CID 139754864
2-hydroxypropanoic acid;2-[2-(2-methoxypropoxy)propoxy]propan-1-ol
CID 86606253
2-(2-methoxypropoxy)propan-1-ol;propane-1,2-diol
CID 87149453
2-ethoxy-2-(2-methoxypropoxy)acetic acid
CID 57284708
(4S)-2-ethoxy-4-methoxypentane
CID 88970287
2-methoxyhexane-1,4,5-triol
CID 145388583
1-[3-(2-hydroxypropoxy)-2-(2-methoxypropoxy)propoxy]propan-2-ol
CID 22947723

Frequently Asked Questions

What is the IUPAC name of 5-(2-ethoxypropoxy)-2-(2-methoxypropoxy)hexane-1,4-diol?
The IUPAC name of 5-(2-ethoxypropoxy)-2-(2-methoxypropoxy)hexane-1,4-diol (CID 57297918) is 5-(2-ethoxypropoxy)-2-(2-methoxypropoxy)hexane-1,4-diol.
What is the SMILES notation for 5-(2-ethoxypropoxy)-2-(2-methoxypropoxy)hexane-1,4-diol?
The canonical SMILES for 5-(2-ethoxypropoxy)-2-(2-methoxypropoxy)hexane-1,4-diol is CCOC(C)COC(C)C(O)CC(CO)OCC(C)OC.
What is the InChIKey of 5-(2-ethoxypropoxy)-2-(2-methoxypropoxy)hexane-1,4-diol?
The InChIKey is FZXXQRMNUGHNAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H32O6/c1-6-19-12(3)10-20-13(4)15(17)7-14(8-16)21-9-11(2)18-5/h11-17H,6-10H2,1-5H3.
What are the key properties of 5-(2-ethoxypropoxy)-2-(2-methoxypropoxy)hexane-1,4-diol?
5-(2-ethoxypropoxy)-2-(2-methoxypropoxy)hexane-1,4-diol has a molecular weight of 308.42 g/mol, XLogP of 0.98, 13 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-ethoxypropoxy)-2-(2-methoxypropoxy)hexane-1,4-diol is sourced from PubChem (CID 57297918), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).