2-ethenoxycarbonyloxyethyl ethenyl carbonate

C8H10O6 — CID 22116731

IUPAC2-ethenoxycarbonyloxyethyl ethenyl carbonate
SMILESC=COC(=O)OCCOC(=O)OC=C
InChIInChI=1S/C8H10O6/c1-3-11-7(9)13-5-6-14-8(10)12-4-2/h3-4H,1-2,5-6H2
InChIKeyZJLIIWMZBBWQGW-UHFFFAOYSA-N
MW202.16 g/mol
LogP1.58
Rot. Bonds5

About 2-ethenoxycarbonyloxyethyl ethenyl carbonate

2-ethenoxycarbonyloxyethyl ethenyl carbonate (PubChem CID 22116731) has the molecular formula C8H10O6 and a molecular weight of 202.16 g/mol. Its IUPAC name is 2-ethenoxycarbonyloxyethyl ethenyl carbonate.

Molecular Properties

Compound Name2-ethenoxycarbonyloxyethyl ethenyl carbonate
PubChem CID22116731
Molecular FormulaC8H10O6
Molecular Weight202.16 g/mol
Exact Mass202.05
IUPAC Name2-ethenoxycarbonyloxyethyl ethenyl carbonate
SMILESC=COC(=O)OCCOC(=O)OC=C
InChIInChI=1S/C8H10O6/c1-3-11-7(9)13-5-6-14-8(10)12-4-2/h3-4H,1-2,5-6H2
InChIKeyZJLIIWMZBBWQGW-UHFFFAOYSA-N
XLogP1.58
TPSA71.06 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.16
LogP ≤ 51.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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-ethenoxycarbonyloxyethyl ethenyl carbonate?
The IUPAC name of 2-ethenoxycarbonyloxyethyl ethenyl carbonate (CID 22116731) is 2-ethenoxycarbonyloxyethyl ethenyl carbonate.
What is the SMILES notation for 2-ethenoxycarbonyloxyethyl ethenyl carbonate?
The canonical SMILES for 2-ethenoxycarbonyloxyethyl ethenyl carbonate is C=COC(=O)OCCOC(=O)OC=C.
What is the InChIKey of 2-ethenoxycarbonyloxyethyl ethenyl carbonate?
The InChIKey is ZJLIIWMZBBWQGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10O6/c1-3-11-7(9)13-5-6-14-8(10)12-4-2/h3-4H,1-2,5-6H2.
What are the key properties of 2-ethenoxycarbonyloxyethyl ethenyl carbonate?
2-ethenoxycarbonyloxyethyl ethenyl carbonate has a molecular weight of 202.16 g/mol, XLogP of 1.58, 5 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethenoxycarbonyloxyethyl ethenyl carbonate is sourced from PubChem (CID 22116731), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).