2-[2-(2-hydroxyethoxy)ethoxy]ethanol;3-methoxyprop-1-ene

C10H22O5 — CID 18464060

IUPAC2-[2-(2-hydroxyethoxy)ethoxy]ethanol;3-methoxyprop-1-ene
SMILESC=CCOC.OCCOCCOCCO
InChIInChI=1S/C6H14O4.C4H8O/c7-1-3-9-5-6-10-4-2-8;1-3-4-5-2/h7-8H,1-6H2;3H,1,4H2,2H3
InChIKeyMPAAMXIVQVDZBP-UHFFFAOYSA-N
MW222.28 g/mol
LogP-0.18
Rot. Bonds9

About 2-[2-(2-hydroxyethoxy)ethoxy]ethanol;3-methoxyprop-1-ene

2-[2-(2-hydroxyethoxy)ethoxy]ethanol;3-methoxyprop-1-ene (PubChem CID 18464060) has the molecular formula C10H22O5 and a molecular weight of 222.28 g/mol. Its IUPAC name is 2-[2-(2-hydroxyethoxy)ethoxy]ethanol;3-methoxyprop-1-ene.

Molecular Properties

Compound Name2-[2-(2-hydroxyethoxy)ethoxy]ethanol;3-methoxyprop-1-ene
PubChem CID18464060
Molecular FormulaC10H22O5
Molecular Weight222.28 g/mol
Exact Mass222.15
IUPAC Name2-[2-(2-hydroxyethoxy)ethoxy]ethanol;3-methoxyprop-1-ene
SMILESC=CCOC.OCCOCCOCCO
InChIInChI=1S/C6H14O4.C4H8O/c7-1-3-9-5-6-10-4-2-8;1-3-4-5-2/h7-8H,1-6H2;3H,1,4H2,2H3
InChIKeyMPAAMXIVQVDZBP-UHFFFAOYSA-N
XLogP-0.18
TPSA68.15 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.28
LogP ≤ 5-0.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-[2-(2-hydroxyethoxy)ethoxy]ethanol;3-methoxyprop-1-ene?
The IUPAC name of 2-[2-(2-hydroxyethoxy)ethoxy]ethanol;3-methoxyprop-1-ene (CID 18464060) is 2-[2-(2-hydroxyethoxy)ethoxy]ethanol;3-methoxyprop-1-ene.
What is the SMILES notation for 2-[2-(2-hydroxyethoxy)ethoxy]ethanol;3-methoxyprop-1-ene?
The canonical SMILES for 2-[2-(2-hydroxyethoxy)ethoxy]ethanol;3-methoxyprop-1-ene is C=CCOC.OCCOCCOCCO.
What is the InChIKey of 2-[2-(2-hydroxyethoxy)ethoxy]ethanol;3-methoxyprop-1-ene?
The InChIKey is MPAAMXIVQVDZBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H14O4.C4H8O/c7-1-3-9-5-6-10-4-2-8;1-3-4-5-2/h7-8H,1-6H2;3H,1,4H2,2H3.
What are the key properties of 2-[2-(2-hydroxyethoxy)ethoxy]ethanol;3-methoxyprop-1-ene?
2-[2-(2-hydroxyethoxy)ethoxy]ethanol;3-methoxyprop-1-ene has a molecular weight of 222.28 g/mol, XLogP of -0.18, 9 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2-hydroxyethoxy)ethoxy]ethanol;3-methoxyprop-1-ene is sourced from PubChem (CID 18464060), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).