2-[2-(2-hydroxyethoxy)ethoxy]ethanol;1-[1-(1-methoxypropan-2-yloxy)propan-2-yloxy]propan-2-ol

C16H36O8 — CID 22051748

IUPAC2-[2-(2-hydroxyethoxy)ethoxy]ethanol;1-[1-(1-methoxypropan-2-yloxy)propan-2-yloxy]propan-2-ol
SMILESCOCC(C)OCC(C)OCC(C)O.OCCOCCOCCO
InChIInChI=1S/C10H22O4.C6H14O4/c1-8(11)5-13-10(3)7-14-9(2)6-12-4;7-1-3-9-5-6-10-4-2-8/h8-11H,5-7H2,1-4H3;7-8H,1-6H2
InChIKeyFKVKYKOZNFSZIJ-UHFFFAOYSA-N
MW356.46 g/mol
LogP-0.17
Rot. Bonds15

About 2-[2-(2-hydroxyethoxy)ethoxy]ethanol;1-[1-(1-methoxypropan-2-yloxy)propan-2-yloxy]propan-2-ol

2-[2-(2-hydroxyethoxy)ethoxy]ethanol;1-[1-(1-methoxypropan-2-yloxy)propan-2-yloxy]propan-2-ol (PubChem CID 22051748) has the molecular formula C16H36O8 and a molecular weight of 356.46 g/mol. Its IUPAC name is 2-[2-(2-hydroxyethoxy)ethoxy]ethanol;1-[1-(1-methoxypropan-2-yloxy)propan-2-yloxy]propan-2-ol.

Molecular Properties

Compound Name2-[2-(2-hydroxyethoxy)ethoxy]ethanol;1-[1-(1-methoxypropan-2-yloxy)propan-2-yloxy]propan-2-ol
PubChem CID22051748
Molecular FormulaC16H36O8
Molecular Weight356.46 g/mol
Exact Mass356.24
IUPAC Name2-[2-(2-hydroxyethoxy)ethoxy]ethanol;1-[1-(1-methoxypropan-2-yloxy)propan-2-yloxy]propan-2-ol
SMILESCOCC(C)OCC(C)OCC(C)O.OCCOCCOCCO
InChIInChI=1S/C10H22O4.C6H14O4/c1-8(11)5-13-10(3)7-14-9(2)6-12-4;7-1-3-9-5-6-10-4-2-8/h8-11H,5-7H2,1-4H3;7-8H,1-6H2
InChIKeyFKVKYKOZNFSZIJ-UHFFFAOYSA-N
XLogP-0.17
TPSA106.84 Ų
H-Bond Donors3
H-Bond Acceptors8
Rotatable Bonds15
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.46
LogP ≤ 5-0.17
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

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

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Related Compounds

2-[2-[2-(2-hydroxypropoxy)propoxy]propoxy]propan-1-ol;2-[2-(2-methoxyethoxy)ethoxy]ethanol
CID 87899229
2-[2-(2-hydroxypropoxy)propoxy]propan-1-ol;2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethanol
CID 22051709
2-[2-(2-hydroxypropoxy)propoxy]propan-1-ol;2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol
CID 22051722
2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol;2-[2-(2-hydroxypropoxy)propoxy]propan-1-ol
CID 22918050
2-(2-hydroxyethoxy)ethanol;1-methoxy-2-(2-methoxypropoxy)propane
CID 175459018
1-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]propan-2-ol
CID 86587580
2-(2-hydroxyethoxy)ethanol;1-[2-(2-hydroxyethoxy)ethoxy]propan-2-ol
CID 161004910
2-[2-[2-[2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol;2-[2-(2-hydroxypropoxy)propoxy]propan-1-ol;bis(2-methylprop-2-enoic acid)
CID 173326767
1-[2-(1-methoxypropan-2-yloxy)ethoxy]propan-2-ol
CID 18709988
(2R)-2-[(2R)-2-[(2R)-2-[(2R)-2-[(2S)-2-[(2R)-2-hydroxypropoxy]propoxy]propoxy]propoxy]propoxy]propan-1-ol
CID 135398128
(2R)-2-[(2R)-2-[(2R)-2-[(2R)-2-[(2R)-2-[(2S)-2-[(2R)-2-hydroxypropoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propan-1-ol
CID 52944184
2-[(2S)-2-(2-hydroxypropoxy)propoxy]propan-1-ol
CID 57250995

Frequently Asked Questions

What is the IUPAC name of 2-[2-(2-hydroxyethoxy)ethoxy]ethanol;1-[1-(1-methoxypropan-2-yloxy)propan-2-yloxy]propan-2-ol?
The IUPAC name of 2-[2-(2-hydroxyethoxy)ethoxy]ethanol;1-[1-(1-methoxypropan-2-yloxy)propan-2-yloxy]propan-2-ol (CID 22051748) is 2-[2-(2-hydroxyethoxy)ethoxy]ethanol;1-[1-(1-methoxypropan-2-yloxy)propan-2-yloxy]propan-2-ol.
What is the SMILES notation for 2-[2-(2-hydroxyethoxy)ethoxy]ethanol;1-[1-(1-methoxypropan-2-yloxy)propan-2-yloxy]propan-2-ol?
The canonical SMILES for 2-[2-(2-hydroxyethoxy)ethoxy]ethanol;1-[1-(1-methoxypropan-2-yloxy)propan-2-yloxy]propan-2-ol is COCC(C)OCC(C)OCC(C)O.OCCOCCOCCO.
What is the InChIKey of 2-[2-(2-hydroxyethoxy)ethoxy]ethanol;1-[1-(1-methoxypropan-2-yloxy)propan-2-yloxy]propan-2-ol?
The InChIKey is FKVKYKOZNFSZIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22O4.C6H14O4/c1-8(11)5-13-10(3)7-14-9(2)6-12-4;7-1-3-9-5-6-10-4-2-8/h8-11H,5-7H2,1-4H3;7-8H,1-6H2.
What are the key properties of 2-[2-(2-hydroxyethoxy)ethoxy]ethanol;1-[1-(1-methoxypropan-2-yloxy)propan-2-yloxy]propan-2-ol?
2-[2-(2-hydroxyethoxy)ethoxy]ethanol;1-[1-(1-methoxypropan-2-yloxy)propan-2-yloxy]propan-2-ol has a molecular weight of 356.46 g/mol, XLogP of -0.17, 15 rotatable bonds, 3 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2-hydroxyethoxy)ethoxy]ethanol;1-[1-(1-methoxypropan-2-yloxy)propan-2-yloxy]propan-2-ol is sourced from PubChem (CID 22051748), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).