2-(2-methoxyethoxy)ethyl methyl carbonate

C7H14O5 — CID 10888474

IUPAC2-(2-methoxyethoxy)ethyl methyl carbonate
SMILESCOCCOCCOC(=O)OC
InChIInChI=1S/C7H14O5/c1-9-3-4-11-5-6-12-7(8)10-2/h3-6H2,1-2H3
InChIKeyOGRDEGQKRDJWRI-UHFFFAOYSA-N
MW178.18 g/mol
LogP0.43
Rot. Bonds6

About 2-(2-methoxyethoxy)ethyl methyl carbonate

2-(2-methoxyethoxy)ethyl methyl carbonate (PubChem CID 10888474) has the molecular formula C7H14O5 and a molecular weight of 178.18 g/mol. Its IUPAC name is 2-(2-methoxyethoxy)ethyl methyl carbonate.

Molecular Properties

Compound Name2-(2-methoxyethoxy)ethyl methyl carbonate
PubChem CID10888474
Molecular FormulaC7H14O5
Molecular Weight178.18 g/mol
Exact Mass178.08
IUPAC Name2-(2-methoxyethoxy)ethyl methyl carbonate
SMILESCOCCOCCOC(=O)OC
InChIInChI=1S/C7H14O5/c1-9-3-4-11-5-6-12-7(8)10-2/h3-6H2,1-2H3
InChIKeyOGRDEGQKRDJWRI-UHFFFAOYSA-N
XLogP0.43
TPSA53.99 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.18
LogP ≤ 50.43
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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Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxyethoxy)ethyl methyl carbonate?
The IUPAC name of 2-(2-methoxyethoxy)ethyl methyl carbonate (CID 10888474) is 2-(2-methoxyethoxy)ethyl methyl carbonate.
What is the SMILES notation for 2-(2-methoxyethoxy)ethyl methyl carbonate?
The canonical SMILES for 2-(2-methoxyethoxy)ethyl methyl carbonate is COCCOCCOC(=O)OC.
What is the InChIKey of 2-(2-methoxyethoxy)ethyl methyl carbonate?
The InChIKey is OGRDEGQKRDJWRI-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14O5/c1-9-3-4-11-5-6-12-7(8)10-2/h3-6H2,1-2H3.
What are the key properties of 2-(2-methoxyethoxy)ethyl methyl carbonate?
2-(2-methoxyethoxy)ethyl methyl carbonate has a molecular weight of 178.18 g/mol, XLogP of 0.43, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxyethoxy)ethyl methyl carbonate is sourced from PubChem (CID 10888474), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).