2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethyl methanesulfonate

C10H22O7S — CID 14763679

IUPAC2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethyl methanesulfonate
SMILESCOCCOCCOCCOCCOS(C)(=O)=O
InChIInChI=1S/C10H22O7S/c1-13-3-4-14-5-6-15-7-8-16-9-10-17-18(2,11)12/h3-10H2,1-2H3
InChIKeyGXMYCEJMFZMVSC-UHFFFAOYSA-N
MW286.35 g/mol
LogP-0.34
Rot. Bonds13

About 2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethyl methanesulfonate

2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethyl methanesulfonate (PubChem CID 14763679) has the molecular formula C10H22O7S and a molecular weight of 286.35 g/mol. Its IUPAC name is 2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethyl methanesulfonate.

Molecular Properties

Compound Name2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethyl methanesulfonate
PubChem CID14763679
Molecular FormulaC10H22O7S
Molecular Weight286.35 g/mol
Exact Mass286.11
IUPAC Name2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethyl methanesulfonate
SMILESCOCCOCCOCCOCCOS(C)(=O)=O
InChIInChI=1S/C10H22O7S/c1-13-3-4-14-5-6-15-7-8-16-9-10-17-18(2,11)12/h3-10H2,1-2H3
InChIKeyGXMYCEJMFZMVSC-UHFFFAOYSA-N
XLogP-0.34
TPSA80.29 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds13
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.35
LogP ≤ 5-0.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Sulfonic_acid_1', 'substructure': 'N/A'}

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Related Compounds

2-Methoxyethyl methanesulfonate
CID 146293
2-(2-(2-Hydroxyethoxy)ethoxy)ethanol,methanesulfonic acid
CID 11077635
Diethylene Glycol Dimethanesulfonate
CID 147571
2-(2-Methoxyethoxy)ethyl methanesulfonate
CID 3815654
2-(2-(2-(2-(2-(2-(2-Methoxyethoxy)ethoxy)ethoxy)ethoxy)ethoxy)ethoxy)ethyl methanesulfonate
CID 21930814
2-(2-(2-Methoxyethoxy)ethoxy)ethyl methanesulfonate
CID 12621272
2-Ethoxyethyl methanesulfonate
CID 15067105
O,O'-(((Oxybis(ethane-2,1-diyl))bis(oxy))bis(ethane-2,1-diyl)) dimethanesulfonothioate
CID 22174344
3,6-Dioxaoctane-1,8-diyl bismethanethiosulfonate
CID 57375736
2-(2-Fluoroethoxy)ethyl methanesulfonate
CID 139941046
3,6,9,12-Tetraoxatetradecane-1,14-diyl dimethanesulfonate
CID 13642703
2-(2-Methoxyethoxy)ethyl ethanesulfonate
CID 139845445

Frequently Asked Questions

What is the IUPAC name of 2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethyl methanesulfonate?
The IUPAC name of 2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethyl methanesulfonate (CID 14763679) is 2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethyl methanesulfonate.
What is the SMILES notation for 2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethyl methanesulfonate?
The canonical SMILES for 2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethyl methanesulfonate is COCCOCCOCCOCCOS(C)(=O)=O.
What is the InChIKey of 2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethyl methanesulfonate?
The InChIKey is GXMYCEJMFZMVSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22O7S/c1-13-3-4-14-5-6-15-7-8-16-9-10-17-18(2,11)12/h3-10H2,1-2H3.
What are the key properties of 2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethyl methanesulfonate?
2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethyl methanesulfonate has a molecular weight of 286.35 g/mol, XLogP of -0.34, 13 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethyl methanesulfonate is sourced from PubChem (CID 14763679), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).