bis(2-ethenoxyethyl) carbonate

C9H14O5 — CID 11830481

IUPACbis(2-ethenoxyethyl) carbonate
SMILESC=COCCOC(=O)OCCOC=C
InChIInChI=1S/C9H14O5/c1-3-11-5-7-13-9(10)14-8-6-12-4-2/h3-4H,1-2,5-8H2
InChIKeyWRNSYKNOJJOABJ-UHFFFAOYSA-N
MW202.21 g/mol
LogP1.46
Rot. Bonds8

About bis(2-ethenoxyethyl) carbonate

bis(2-ethenoxyethyl) carbonate (PubChem CID 11830481) has the molecular formula C9H14O5 and a molecular weight of 202.21 g/mol. Its IUPAC name is bis(2-ethenoxyethyl) carbonate.

Molecular Properties

Compound Namebis(2-ethenoxyethyl) carbonate
PubChem CID11830481
Molecular FormulaC9H14O5
Molecular Weight202.21 g/mol
Exact Mass202.08
IUPAC Namebis(2-ethenoxyethyl) carbonate
SMILESC=COCCOC(=O)OCCOC=C
InChIInChI=1S/C9H14O5/c1-3-11-5-7-13-9(10)14-8-6-12-4-2/h3-4H,1-2,5-8H2
InChIKeyWRNSYKNOJJOABJ-UHFFFAOYSA-N
XLogP1.46
TPSA53.99 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.21
LogP ≤ 51.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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 bis(2-ethenoxyethyl) carbonate?
The IUPAC name of bis(2-ethenoxyethyl) carbonate (CID 11830481) is bis(2-ethenoxyethyl) carbonate.
What is the SMILES notation for bis(2-ethenoxyethyl) carbonate?
The canonical SMILES for bis(2-ethenoxyethyl) carbonate is C=COCCOC(=O)OCCOC=C.
What is the InChIKey of bis(2-ethenoxyethyl) carbonate?
The InChIKey is WRNSYKNOJJOABJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14O5/c1-3-11-5-7-13-9(10)14-8-6-12-4-2/h3-4H,1-2,5-8H2.
What are the key properties of bis(2-ethenoxyethyl) carbonate?
bis(2-ethenoxyethyl) carbonate has a molecular weight of 202.21 g/mol, XLogP of 1.46, 8 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for bis(2-ethenoxyethyl) carbonate is sourced from PubChem (CID 11830481), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).