2-[2-[2-(2-methoxyethoxy)ethoxy]ethylsulfinyl]ethanol

C9H20O5S — CID 158833694

IUPAC2-[2-[2-(2-methoxyethoxy)ethoxy]ethylsulfinyl]ethanol
SMILESCOCCOCCOCCS(=O)CCO
InChIInChI=1S/C9H20O5S/c1-12-3-4-13-5-6-14-7-9-15(11)8-2-10/h10H,2-9H2,1H3
InChIKeyIXJBJTYMRQILHZ-UHFFFAOYSA-N
MW240.32 g/mol
LogP-0.59
Rot. Bonds11

About 2-[2-[2-(2-methoxyethoxy)ethoxy]ethylsulfinyl]ethanol

2-[2-[2-(2-methoxyethoxy)ethoxy]ethylsulfinyl]ethanol (PubChem CID 158833694) has the molecular formula C9H20O5S and a molecular weight of 240.32 g/mol. Its IUPAC name is 2-[2-[2-(2-methoxyethoxy)ethoxy]ethylsulfinyl]ethanol.

Molecular Properties

Compound Name2-[2-[2-(2-methoxyethoxy)ethoxy]ethylsulfinyl]ethanol
PubChem CID158833694
Molecular FormulaC9H20O5S
Molecular Weight240.32 g/mol
Exact Mass240.10
IUPAC Name2-[2-[2-(2-methoxyethoxy)ethoxy]ethylsulfinyl]ethanol
SMILESCOCCOCCOCCS(=O)CCO
InChIInChI=1S/C9H20O5S/c1-12-3-4-13-5-6-14-7-9-15(11)8-2-10/h10H,2-9H2,1H3
InChIKeyIXJBJTYMRQILHZ-UHFFFAOYSA-N
XLogP-0.59
TPSA64.99 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds11
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.32
LogP ≤ 5-0.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

4-[2-(2-methoxyethoxy)ethylsulfinyl]butan-2-amine
CID 81195475
2-methoxyethanol;2-(2-methoxyethoxy)ethanol
CID 87975598
sodium;ethane-1,2-diol;1-methoxy-2-(2-methoxyethoxy)ethane;hydroxide
CID 173220680
2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethanol;hydroiodide
CID 88616948
ethane-1,2-diol;2-methoxyethanol;1-methoxy-2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethane
CID 161198801
ethanol;1-methoxy-2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethane
CID 87301416
2-(2-methoxyethoxymethoxy)ethanesulfinate
CID 57218181
1-methoxy-2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethane
CID 87439194
1-methoxy-2-[2-(2-methoxyethoxy)ethoxy]ethane
CID 8189
1,2-dimethoxyethane;1-methoxy-2-(2-methoxyethoxy)ethane;1-methoxy-2-[2-(2-methoxyethoxy)ethoxy]ethane;1-methoxy-2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethane
CID 159847962
3-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]propan-1-ol
CID 91809447
2-[3-(2-methoxyethoxy)propylsulfinyl]acetic acid
CID 103411624

Frequently Asked Questions

What is the IUPAC name of 2-[2-[2-(2-methoxyethoxy)ethoxy]ethylsulfinyl]ethanol?
The IUPAC name of 2-[2-[2-(2-methoxyethoxy)ethoxy]ethylsulfinyl]ethanol (CID 158833694) is 2-[2-[2-(2-methoxyethoxy)ethoxy]ethylsulfinyl]ethanol.
What is the SMILES notation for 2-[2-[2-(2-methoxyethoxy)ethoxy]ethylsulfinyl]ethanol?
The canonical SMILES for 2-[2-[2-(2-methoxyethoxy)ethoxy]ethylsulfinyl]ethanol is COCCOCCOCCS(=O)CCO.
What is the InChIKey of 2-[2-[2-(2-methoxyethoxy)ethoxy]ethylsulfinyl]ethanol?
The InChIKey is IXJBJTYMRQILHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20O5S/c1-12-3-4-13-5-6-14-7-9-15(11)8-2-10/h10H,2-9H2,1H3.
What are the key properties of 2-[2-[2-(2-methoxyethoxy)ethoxy]ethylsulfinyl]ethanol?
2-[2-[2-(2-methoxyethoxy)ethoxy]ethylsulfinyl]ethanol has a molecular weight of 240.32 g/mol, XLogP of -0.59, 11 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[2-(2-methoxyethoxy)ethoxy]ethylsulfinyl]ethanol is sourced from PubChem (CID 158833694), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).