ethene;2-prop-2-enoxycarbonyloxyethyl prop-2-enyl carbonate

C12H18O6 — CID 22459483

IUPACethene;2-prop-2-enoxycarbonyloxyethyl prop-2-enyl carbonate
SMILESC=C.C=CCOC(=O)OCCOC(=O)OCC=C
InChIInChI=1S/C10H14O6.C2H4/c1-3-5-13-9(11)15-7-8-16-10(12)14-6-4-2;1-2/h3-4H,1-2,5-8H2;1-2H2
InChIKeyJQSKGMDQYOYBFM-UHFFFAOYSA-N
MW258.27 g/mol
LogP2.47
Rot. Bonds7

About ethene;2-prop-2-enoxycarbonyloxyethyl prop-2-enyl carbonate

ethene;2-prop-2-enoxycarbonyloxyethyl prop-2-enyl carbonate (PubChem CID 22459483) has the molecular formula C12H18O6 and a molecular weight of 258.27 g/mol. Its IUPAC name is ethene;2-prop-2-enoxycarbonyloxyethyl prop-2-enyl carbonate.

Molecular Properties

Compound Nameethene;2-prop-2-enoxycarbonyloxyethyl prop-2-enyl carbonate
PubChem CID22459483
Molecular FormulaC12H18O6
Molecular Weight258.27 g/mol
Exact Mass258.11
IUPAC Nameethene;2-prop-2-enoxycarbonyloxyethyl prop-2-enyl carbonate
SMILESC=C.C=CCOC(=O)OCCOC(=O)OCC=C
InChIInChI=1S/C10H14O6.C2H4/c1-3-5-13-9(11)15-7-8-16-10(12)14-6-4-2;1-2/h3-4H,1-2,5-8H2;1-2H2
InChIKeyJQSKGMDQYOYBFM-UHFFFAOYSA-N
XLogP2.47
TPSA71.06 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.27
LogP ≤ 52.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

bis(prop-2-enyl) carbonate;ethene
CID 87465968
CID 140777128
CID 140777128
3-[2-(2-prop-2-enoxycarbonyloxyethoxy)ethoxycarbonyloxy]propyl prop-2-enyl carbonate
CID 23533996
2-(2-carboxyoxyethoxy)ethyl prop-2-enyl carbonate
CID 87661731
2-[2-(2-hydroxyethoxy)ethoxy]ethyl prop-2-enyl carbonate
CID 91326710
2-prop-2-enoxycarbonyloxyethyl 2-methylprop-2-enoate
CID 88775356
bis(prop-2-enyl) carbonate;isocyanic acid
CID 88769513
bis(prop-2-enyl) carbonate;2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethanol
CID 22918048
6-bromohexyl prop-2-enyl carbonate
CID 10890766
iodo prop-2-enyl carbonate
CID 87691823
2-methylpropyl prop-2-enyl carbonate
CID 6420250
benzene-1,2-diol;bis(prop-2-enyl) carbonate
CID 23056283

Frequently Asked Questions

What is the IUPAC name of ethene;2-prop-2-enoxycarbonyloxyethyl prop-2-enyl carbonate?
The IUPAC name of ethene;2-prop-2-enoxycarbonyloxyethyl prop-2-enyl carbonate (CID 22459483) is ethene;2-prop-2-enoxycarbonyloxyethyl prop-2-enyl carbonate.
What is the SMILES notation for ethene;2-prop-2-enoxycarbonyloxyethyl prop-2-enyl carbonate?
The canonical SMILES for ethene;2-prop-2-enoxycarbonyloxyethyl prop-2-enyl carbonate is C=C.C=CCOC(=O)OCCOC(=O)OCC=C.
What is the InChIKey of ethene;2-prop-2-enoxycarbonyloxyethyl prop-2-enyl carbonate?
The InChIKey is JQSKGMDQYOYBFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14O6.C2H4/c1-3-5-13-9(11)15-7-8-16-10(12)14-6-4-2;1-2/h3-4H,1-2,5-8H2;1-2H2.
What are the key properties of ethene;2-prop-2-enoxycarbonyloxyethyl prop-2-enyl carbonate?
ethene;2-prop-2-enoxycarbonyloxyethyl prop-2-enyl carbonate has a molecular weight of 258.27 g/mol, XLogP of 2.47, 7 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for ethene;2-prop-2-enoxycarbonyloxyethyl prop-2-enyl carbonate is sourced from PubChem (CID 22459483), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).