bis(ethenyl) carbonate;dimethyl carbonate

C8H12O6 — CID 134305362

IUPACbis(ethenyl) carbonate;dimethyl carbonate
SMILESC=COC(=O)OC=C.COC(=O)OC
InChIInChI=1S/C5H6O3.C3H6O3/c1-3-7-5(6)8-4-2;1-5-3(4)6-2/h3-4H,1-2H2;1-2H3
InChIKeyGTPWHTQAWDIELW-UHFFFAOYSA-N
MW204.18 g/mol
LogP1.83
Rot. Bonds2

About bis(ethenyl) carbonate;dimethyl carbonate

bis(ethenyl) carbonate;dimethyl carbonate (PubChem CID 134305362) has the molecular formula C8H12O6 and a molecular weight of 204.18 g/mol. Its IUPAC name is bis(ethenyl) carbonate;dimethyl carbonate.

Molecular Properties

Compound Namebis(ethenyl) carbonate;dimethyl carbonate
PubChem CID134305362
Molecular FormulaC8H12O6
Molecular Weight204.18 g/mol
Exact Mass204.06
IUPAC Namebis(ethenyl) carbonate;dimethyl carbonate
SMILESC=COC(=O)OC=C.COC(=O)OC
InChIInChI=1S/C5H6O3.C3H6O3/c1-3-7-5(6)8-4-2;1-5-3(4)6-2/h3-4H,1-2H2;1-2H3
InChIKeyGTPWHTQAWDIELW-UHFFFAOYSA-N
XLogP1.83
TPSA71.06 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.18
LogP ≤ 51.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

Ethyl 1-methoxyethenyl carbonate
CID 12632739
Ethyl vinyl carbonate
CID 13668430
Ethenyl methyl carbonate
CID 14122296
1,3-Dioxol-2-one;ethenyl acetate
CID 66777759
Divinyl dicarbonate
CID 87188259
1,1,1-Tris(ethenoxy)ethane
CID 11744867
2-Ethenoxyethyl methyl carbonate
CID 11804902
Bis(2-ethenoxyethyl) carbonate
CID 11830481
1,1,1-Tris(ethenoxy)propane
CID 19991081
1,1-Bis(ethenoxy)-1,2-dimethoxyethane
CID 20380137
3-Ethenoxycarbonyloxypropyl ethenyl carbonate
CID 21183533
Ethylenglykolbis(vinylcarbonat)
CID 22116731

Frequently Asked Questions

What is the IUPAC name of bis(ethenyl) carbonate;dimethyl carbonate?
The IUPAC name of bis(ethenyl) carbonate;dimethyl carbonate (CID 134305362) is bis(ethenyl) carbonate;dimethyl carbonate.
What is the SMILES notation for bis(ethenyl) carbonate;dimethyl carbonate?
The canonical SMILES for bis(ethenyl) carbonate;dimethyl carbonate is C=COC(=O)OC=C.COC(=O)OC.
What is the InChIKey of bis(ethenyl) carbonate;dimethyl carbonate?
The InChIKey is GTPWHTQAWDIELW-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H6O3.C3H6O3/c1-3-7-5(6)8-4-2;1-5-3(4)6-2/h3-4H,1-2H2;1-2H3.
What are the key properties of bis(ethenyl) carbonate;dimethyl carbonate?
bis(ethenyl) carbonate;dimethyl carbonate has a molecular weight of 204.18 g/mol, XLogP of 1.83, 2 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for bis(ethenyl) carbonate;dimethyl carbonate is sourced from PubChem (CID 134305362), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).