2-[2-(2-hydroxyethoxy)propan-2-yloxy]ethanol

C7H16O4 — CID 19366554

IUPAC2-[2-(2-hydroxyethoxy)propan-2-yloxy]ethanol
SMILESCC(C)(OCCO)OCCO
InChIInChI=1S/C7H16O4/c1-7(2,10-5-3-8)11-6-4-9/h8-9H,3-6H2,1-2H3
InChIKeyAKAOLPXFUWHSNP-UHFFFAOYSA-N
MW164.20 g/mol
LogP-0.26
Rot. Bonds6

About 2-[2-(2-hydroxyethoxy)propan-2-yloxy]ethanol

2-[2-(2-hydroxyethoxy)propan-2-yloxy]ethanol (PubChem CID 19366554) has the molecular formula C7H16O4 and a molecular weight of 164.20 g/mol. Its IUPAC name is 2-[2-(2-hydroxyethoxy)propan-2-yloxy]ethanol.

Molecular Properties

Compound Name2-[2-(2-hydroxyethoxy)propan-2-yloxy]ethanol
PubChem CID19366554
Molecular FormulaC7H16O4
Molecular Weight164.20 g/mol
Exact Mass164.10
IUPAC Name2-[2-(2-hydroxyethoxy)propan-2-yloxy]ethanol
SMILESCC(C)(OCCO)OCCO
InChIInChI=1S/C7H16O4/c1-7(2,10-5-3-8)11-6-4-9/h8-9H,3-6H2,1-2H3
InChIKeyAKAOLPXFUWHSNP-UHFFFAOYSA-N
XLogP-0.26
TPSA58.92 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.20
LogP ≤ 5-0.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

3,3-Diethoxy-1,2-propanediol
CID 542749
1,1-Diethoxy-2-propanol
CID 13601575
(R)-(-)-2-((RS)-1-Ethoxyethoxy)-1-propanol
CID 400539
2-(3,3-Diethoxypropoxy)ethan-1-ol
CID 13183693
1-Propanol, 2-(1-ethoxyethoxy)-, [S-(R*,S*)]-
CID 101001545
2-[(2R)-2-(hydroxymethoxy)propoxy]ethanol
CID 137348416
2,5-Diethoxy-2,5-bis(hydroxymethyl)-1,4-dioxane
CID 10879102
1,1,3,3-Tetraethoxypropan-2-ol
CID 13625221
Dibutoxytetraathylenglykol
CID 21391722
l-Glyceraldehyde-diethylacetal
CID 41098036
2-(2-Methoxyethoxy)-2-ethoxyethanol
CID 53638129
4-(Hydroxymethyl)-2,2-dimethyl-1,3-dioxolan-4-ol
CID 57010938

Frequently Asked Questions

What is the IUPAC name of 2-[2-(2-hydroxyethoxy)propan-2-yloxy]ethanol?
The IUPAC name of 2-[2-(2-hydroxyethoxy)propan-2-yloxy]ethanol (CID 19366554) is 2-[2-(2-hydroxyethoxy)propan-2-yloxy]ethanol.
What is the SMILES notation for 2-[2-(2-hydroxyethoxy)propan-2-yloxy]ethanol?
The canonical SMILES for 2-[2-(2-hydroxyethoxy)propan-2-yloxy]ethanol is CC(C)(OCCO)OCCO.
What is the InChIKey of 2-[2-(2-hydroxyethoxy)propan-2-yloxy]ethanol?
The InChIKey is AKAOLPXFUWHSNP-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H16O4/c1-7(2,10-5-3-8)11-6-4-9/h8-9H,3-6H2,1-2H3.
What are the key properties of 2-[2-(2-hydroxyethoxy)propan-2-yloxy]ethanol?
2-[2-(2-hydroxyethoxy)propan-2-yloxy]ethanol has a molecular weight of 164.20 g/mol, XLogP of -0.26, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2-hydroxyethoxy)propan-2-yloxy]ethanol is sourced from PubChem (CID 19366554), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).