1-[1,3-bis(2-methoxyethoxy)propan-2-yloxy]-3-(2-methoxyethoxy)propan-2-ol

C15H32O8 — CID 132556170

IUPAC1-[1,3-bis(2-methoxyethoxy)propan-2-yloxy]-3-(2-methoxyethoxy)propan-2-ol
SMILESCOCCOCC(O)COC(COCCOC)COCCOC
InChIInChI=1S/C15H32O8/c1-17-4-7-20-10-14(16)11-23-15(12-21-8-5-18-2)13-22-9-6-19-3/h14-16H,4-13H2,1-3H3
InChIKeyVEUNTBXCDJYBFK-UHFFFAOYSA-N
MW340.41 g/mol
LogP-0.28
Rot. Bonds18

About 1-[1,3-bis(2-methoxyethoxy)propan-2-yloxy]-3-(2-methoxyethoxy)propan-2-ol

1-[1,3-bis(2-methoxyethoxy)propan-2-yloxy]-3-(2-methoxyethoxy)propan-2-ol (PubChem CID 132556170) has the molecular formula C15H32O8 and a molecular weight of 340.41 g/mol. Its IUPAC name is 1-[1,3-bis(2-methoxyethoxy)propan-2-yloxy]-3-(2-methoxyethoxy)propan-2-ol.

Molecular Properties

Compound Name1-[1,3-bis(2-methoxyethoxy)propan-2-yloxy]-3-(2-methoxyethoxy)propan-2-ol
PubChem CID132556170
Molecular FormulaC15H32O8
Molecular Weight340.41 g/mol
Exact Mass340.21
IUPAC Name1-[1,3-bis(2-methoxyethoxy)propan-2-yloxy]-3-(2-methoxyethoxy)propan-2-ol
SMILESCOCCOCC(O)COC(COCCOC)COCCOC
InChIInChI=1S/C15H32O8/c1-17-4-7-20-10-14(16)11-23-15(12-21-8-5-18-2)13-22-9-6-19-3/h14-16H,4-13H2,1-3H3
InChIKeyVEUNTBXCDJYBFK-UHFFFAOYSA-N
XLogP-0.28
TPSA84.84 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds18
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.41
LogP ≤ 5-0.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

1,3-bis(1,3-dimethoxypropan-2-yloxy)propan-2-ol
CID 71445138
1-methoxy-3-[3-(2-methoxyethoxy)propoxy]propan-2-ol
CID 107508453
1-(1,3-dioctoxypropan-2-yloxy)-3-octoxypropan-2-ol
CID 87462950
1-(2-methoxyethoxy)butan-2-ol
CID 20514540
1-(2-methoxyethoxy)-3-[1-(methylamino)propan-2-yloxy]propan-2-ol
CID 106991208
1-chloro-3-(2-methoxyethoxy)propan-2-ol
CID 4581090
1-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]butan-2-ol
CID 104564611
3-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]propane-1,2-diol
CID 88556608
1-[1,3-bis(2-methoxyethoxy)propan-2-yloxy]-2-[1,3-bis(2-methoxyethoxy)propan-2-yloxymethyl]-3,3-dimethylbutane;1-(1,3-dimethoxypropan-2-yloxy)-2-(1,3-dimethoxypropan-2-yloxymethyl)-3,3-dimethylbutane
CID 165060028
1-[3-[3-[[[3-[2,3-bis(2-hydroxy-3-methoxypropoxy)propoxy]propyl-dimethylsilyl]oxy-dimethylsilyl]oxy-dimethylsilyl]propoxy]-2-(2-hydroxy-3-methoxypropoxy)propoxy]-3-methoxypropan-2-ol
CID 59187876
1-[2,3-bis(2-hydroxybutoxy)propoxy]butan-2-ol
CID 22947936
1-(2-methoxyethoxy)heptane-2,5-diol
CID 106992811

Frequently Asked Questions

What is the IUPAC name of 1-[1,3-bis(2-methoxyethoxy)propan-2-yloxy]-3-(2-methoxyethoxy)propan-2-ol?
The IUPAC name of 1-[1,3-bis(2-methoxyethoxy)propan-2-yloxy]-3-(2-methoxyethoxy)propan-2-ol (CID 132556170) is 1-[1,3-bis(2-methoxyethoxy)propan-2-yloxy]-3-(2-methoxyethoxy)propan-2-ol.
What is the SMILES notation for 1-[1,3-bis(2-methoxyethoxy)propan-2-yloxy]-3-(2-methoxyethoxy)propan-2-ol?
The canonical SMILES for 1-[1,3-bis(2-methoxyethoxy)propan-2-yloxy]-3-(2-methoxyethoxy)propan-2-ol is COCCOCC(O)COC(COCCOC)COCCOC.
What is the InChIKey of 1-[1,3-bis(2-methoxyethoxy)propan-2-yloxy]-3-(2-methoxyethoxy)propan-2-ol?
The InChIKey is VEUNTBXCDJYBFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H32O8/c1-17-4-7-20-10-14(16)11-23-15(12-21-8-5-18-2)13-22-9-6-19-3/h14-16H,4-13H2,1-3H3.
What are the key properties of 1-[1,3-bis(2-methoxyethoxy)propan-2-yloxy]-3-(2-methoxyethoxy)propan-2-ol?
1-[1,3-bis(2-methoxyethoxy)propan-2-yloxy]-3-(2-methoxyethoxy)propan-2-ol has a molecular weight of 340.41 g/mol, XLogP of -0.28, 18 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1,3-bis(2-methoxyethoxy)propan-2-yloxy]-3-(2-methoxyethoxy)propan-2-ol is sourced from PubChem (CID 132556170), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).