2-ethenoxyethyl methyl carbonate

C6H10O4 — CID 11804902

IUPAC2-ethenoxyethyl methyl carbonate
SMILESC=COCCOC(=O)OC
InChIInChI=1S/C6H10O4/c1-3-9-4-5-10-6(7)8-2/h3H,1,4-5H2,2H3
InChIKeyGXEDVFPOHKBTFN-UHFFFAOYSA-N
MW146.14 g/mol
LogP0.93
Rot. Bonds4

About 2-ethenoxyethyl methyl carbonate

2-ethenoxyethyl methyl carbonate (PubChem CID 11804902) has the molecular formula C6H10O4 and a molecular weight of 146.14 g/mol. Its IUPAC name is 2-ethenoxyethyl methyl carbonate.

Molecular Properties

Compound Name2-ethenoxyethyl methyl carbonate
PubChem CID11804902
Molecular FormulaC6H10O4
Molecular Weight146.14 g/mol
Exact Mass146.06
IUPAC Name2-ethenoxyethyl methyl carbonate
SMILESC=COCCOC(=O)OC
InChIInChI=1S/C6H10O4/c1-3-9-4-5-10-6(7)8-2/h3H,1,4-5H2,2H3
InChIKeyGXEDVFPOHKBTFN-UHFFFAOYSA-N
XLogP0.93
TPSA44.76 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.14
LogP ≤ 50.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-ethenoxyethyl methyl carbonate?
The IUPAC name of 2-ethenoxyethyl methyl carbonate (CID 11804902) is 2-ethenoxyethyl methyl carbonate.
What is the SMILES notation for 2-ethenoxyethyl methyl carbonate?
The canonical SMILES for 2-ethenoxyethyl methyl carbonate is C=COCCOC(=O)OC.
What is the InChIKey of 2-ethenoxyethyl methyl carbonate?
The InChIKey is GXEDVFPOHKBTFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10O4/c1-3-9-4-5-10-6(7)8-2/h3H,1,4-5H2,2H3.
What are the key properties of 2-ethenoxyethyl methyl carbonate?
2-ethenoxyethyl methyl carbonate has a molecular weight of 146.14 g/mol, XLogP of 0.93, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethenoxyethyl methyl carbonate is sourced from PubChem (CID 11804902), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).