2-[2-(2-hydroxyethoxy)ethoxy]ethanol;methyl hypochlorite

C7H17ClO5 — CID 174668360

IUPAC2-[2-(2-hydroxyethoxy)ethoxy]ethanol;methyl hypochlorite
SMILESCOCl.OCCOCCOCCO
InChIInChI=1S/C6H14O4.CH3ClO/c7-1-3-9-5-6-10-4-2-8;1-3-2/h7-8H,1-6H2;1H3
InChIKeySYQXOVMVNWXXFG-UHFFFAOYSA-N
MW216.66 g/mol
LogP-0.21
Rot. Bonds7

About 2-[2-(2-hydroxyethoxy)ethoxy]ethanol;methyl hypochlorite

2-[2-(2-hydroxyethoxy)ethoxy]ethanol;methyl hypochlorite (PubChem CID 174668360) has the molecular formula C7H17ClO5 and a molecular weight of 216.66 g/mol. Its IUPAC name is 2-[2-(2-hydroxyethoxy)ethoxy]ethanol;methyl hypochlorite.

Molecular Properties

Compound Name2-[2-(2-hydroxyethoxy)ethoxy]ethanol;methyl hypochlorite
PubChem CID174668360
Molecular FormulaC7H17ClO5
Molecular Weight216.66 g/mol
Exact Mass216.08
IUPAC Name2-[2-(2-hydroxyethoxy)ethoxy]ethanol;methyl hypochlorite
SMILESCOCl.OCCOCCOCCO
InChIInChI=1S/C6H14O4.CH3ClO/c7-1-3-9-5-6-10-4-2-8;1-3-2/h7-8H,1-6H2;1H3
InChIKeySYQXOVMVNWXXFG-UHFFFAOYSA-N
XLogP-0.21
TPSA68.15 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.66
LogP ≤ 5-0.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-[2-(2-hydroxyethoxy)ethoxy]ethanol;methyl hypochlorite?
The IUPAC name of 2-[2-(2-hydroxyethoxy)ethoxy]ethanol;methyl hypochlorite (CID 174668360) is 2-[2-(2-hydroxyethoxy)ethoxy]ethanol;methyl hypochlorite.
What is the SMILES notation for 2-[2-(2-hydroxyethoxy)ethoxy]ethanol;methyl hypochlorite?
The canonical SMILES for 2-[2-(2-hydroxyethoxy)ethoxy]ethanol;methyl hypochlorite is COCl.OCCOCCOCCO.
What is the InChIKey of 2-[2-(2-hydroxyethoxy)ethoxy]ethanol;methyl hypochlorite?
The InChIKey is SYQXOVMVNWXXFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H14O4.CH3ClO/c7-1-3-9-5-6-10-4-2-8;1-3-2/h7-8H,1-6H2;1H3.
What are the key properties of 2-[2-(2-hydroxyethoxy)ethoxy]ethanol;methyl hypochlorite?
2-[2-(2-hydroxyethoxy)ethoxy]ethanol;methyl hypochlorite has a molecular weight of 216.66 g/mol, XLogP of -0.21, 7 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;methyl hypochlorite is sourced from PubChem (CID 174668360), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).