1-methoxy-2-(2-methoxyethoxy)ethane;thiolane 1,1-dioxide

C10H22O5S — CID 70485099

IUPAC1-methoxy-2-(2-methoxyethoxy)ethane;thiolane 1,1-dioxide
SMILESCOCCOCCOC.O=S1(=O)CCCC1
InChIInChI=1S/C6H14O3.C4H8O2S/c1-7-3-5-9-6-4-8-2;5-7(6)3-1-2-4-7/h3-6H2,1-2H3;1-4H2
InChIKeyVNQJSZAEVPIKPF-UHFFFAOYSA-N
MW254.35 g/mol
LogP0.49
Rot. Bonds6

About 1-methoxy-2-(2-methoxyethoxy)ethane;thiolane 1,1-dioxide

1-methoxy-2-(2-methoxyethoxy)ethane;thiolane 1,1-dioxide (PubChem CID 70485099) has the molecular formula C10H22O5S and a molecular weight of 254.35 g/mol. Its IUPAC name is 1-methoxy-2-(2-methoxyethoxy)ethane;thiolane 1,1-dioxide.

Molecular Properties

Compound Name1-methoxy-2-(2-methoxyethoxy)ethane;thiolane 1,1-dioxide
PubChem CID70485099
Molecular FormulaC10H22O5S
Molecular Weight254.35 g/mol
Exact Mass254.12
IUPAC Name1-methoxy-2-(2-methoxyethoxy)ethane;thiolane 1,1-dioxide
SMILESCOCCOCCOC.O=S1(=O)CCCC1
InChIInChI=1S/C6H14O3.C4H8O2S/c1-7-3-5-9-6-4-8-2;5-7(6)3-1-2-4-7/h3-6H2,1-2H3;1-4H2
InChIKeyVNQJSZAEVPIKPF-UHFFFAOYSA-N
XLogP0.49
TPSA61.83 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.35
LogP ≤ 50.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

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
CID 172826348
CID 172826348
lithium bis(1-methoxy-2-(2-methoxyethoxy)ethane)
CID 5257331
1-methoxy-2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethane;neodymium
CID 161321430
CID 173303266
CID 173303266
1-methoxy-2-(2-methoxyethoxy)ethane;tellane
CID 175355772
ethane;thiepane 1,1-dioxide
CID 91582088
1-methoxy-2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethylperoxy]ethoxy]ethoxy]ethylperoxy]ethoxy]ethoxy]ethylperoxy]ethoxy]ethoxy]ethylperoxy]ethoxy]ethoxy]ethylperoxy]ethoxy]ethoxy]ethylperoxy]ethoxy]ethoxy]ethylperoxy]ethoxy]ethoxy]ethylperoxy]ethoxy]ethoxy]ethylperoxy]ethoxy]ethoxy]ethylperoxy]ethoxy]ethoxy]ethylperoxy]ethoxy]ethoxy]ethylperoxy]ethoxy]ethoxy]ethylperoxy]ethoxy]ethoxy]ethylperoxy]ethoxy]ethoxy]ethylperoxy]ethoxy]ethoxy]ethylperoxy]ethoxy]ethoxy]ethylperoxy]ethoxy]ethoxy]ethylperoxy]ethoxy]ethoxy]ethylperoxy]ethoxy]ethoxy]ethylperoxy]ethoxy]ethoxy]ethylperoxy]ethoxy]ethoxy]ethylperoxy]ethoxy]ethoxy]ethylperoxy]ethoxy]ethoxy]ethylperoxy]ethoxy]ethoxy]ethylperoxy]ethoxy]ethoxy]ethylperoxy]ethoxy]ethoxy]ethylperoxy]ethoxy]ethoxy]ethylperoxy]ethoxy]ethoxy]ethylperoxy]ethoxy]ethoxy]ethylperoxy]ethoxy]ethoxy]ethylperoxy]ethoxy]ethoxy]ethane
CID 140812368
zinc;carbanide;1-methoxy-2-(2-methoxyethoxy)ethane
CID 161464033
ethene;1-methoxy-2-[2-(2-methoxyethoxy)ethoxy]ethane
CID 87459571

Frequently Asked Questions

What is the IUPAC name of 1-methoxy-2-(2-methoxyethoxy)ethane;thiolane 1,1-dioxide?
The IUPAC name of 1-methoxy-2-(2-methoxyethoxy)ethane;thiolane 1,1-dioxide (CID 70485099) is 1-methoxy-2-(2-methoxyethoxy)ethane;thiolane 1,1-dioxide.
What is the SMILES notation for 1-methoxy-2-(2-methoxyethoxy)ethane;thiolane 1,1-dioxide?
The canonical SMILES for 1-methoxy-2-(2-methoxyethoxy)ethane;thiolane 1,1-dioxide is COCCOCCOC.O=S1(=O)CCCC1.
What is the InChIKey of 1-methoxy-2-(2-methoxyethoxy)ethane;thiolane 1,1-dioxide?
The InChIKey is VNQJSZAEVPIKPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H14O3.C4H8O2S/c1-7-3-5-9-6-4-8-2;5-7(6)3-1-2-4-7/h3-6H2,1-2H3;1-4H2.
What are the key properties of 1-methoxy-2-(2-methoxyethoxy)ethane;thiolane 1,1-dioxide?
1-methoxy-2-(2-methoxyethoxy)ethane;thiolane 1,1-dioxide has a molecular weight of 254.35 g/mol, XLogP of 0.49, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methoxy-2-(2-methoxyethoxy)ethane;thiolane 1,1-dioxide is sourced from PubChem (CID 70485099), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).