ethene;(4Z)-4-[(2-oxo-1,3-dioxolan-4-yl)methylidene]-1,3-dioxolan-2-one

C9H10O6 — CID 159799122

IUPACethene;(4Z)-4-[(2-oxo-1,3-dioxolan-4-yl)methylidene]-1,3-dioxolan-2-one
SMILESC=C.O=C1OC/C(=C/C2COC(=O)O2)O1
InChIInChI=1S/C7H6O6.C2H4/c8-6-10-2-4(12-6)1-5-3-11-7(9)13-5;1-2/h1,4H,2-3H2;1-2H2/b5-1-;
InChIKeyNJODCYKPBITEIW-QYUSEIPKSA-N
MW214.17 g/mol
LogP1.37
Rot. Bonds1

About ethene;(4Z)-4-[(2-oxo-1,3-dioxolan-4-yl)methylidene]-1,3-dioxolan-2-one

ethene;(4Z)-4-[(2-oxo-1,3-dioxolan-4-yl)methylidene]-1,3-dioxolan-2-one (PubChem CID 159799122) has the molecular formula C9H10O6 and a molecular weight of 214.17 g/mol. Its IUPAC name is ethene;(4Z)-4-[(2-oxo-1,3-dioxolan-4-yl)methylidene]-1,3-dioxolan-2-one.

Molecular Properties

Compound Nameethene;(4Z)-4-[(2-oxo-1,3-dioxolan-4-yl)methylidene]-1,3-dioxolan-2-one
PubChem CID159799122
Molecular FormulaC9H10O6
Molecular Weight214.17 g/mol
Exact Mass214.05
IUPAC Nameethene;(4Z)-4-[(2-oxo-1,3-dioxolan-4-yl)methylidene]-1,3-dioxolan-2-one
SMILESC=C.O=C1OC/C(=C/C2COC(=O)O2)O1
InChIInChI=1S/C7H6O6.C2H4/c8-6-10-2-4(12-6)1-5-3-11-7(9)13-5;1-2/h1,4H,2-3H2;1-2H2/b5-1-;
InChIKeyNJODCYKPBITEIW-QYUSEIPKSA-N
XLogP1.37
TPSA71.06 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.17
LogP ≤ 51.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

(4R)-4-[(E)-2-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]ethenyl]-2,2-dimethyl-1,3-dioxolane
CID 11310734
4-Ethylidene-5-(1-methoxyethenyl)-1,3-dioxolan-2-one
CID 91192097
4-[(E)-2-(2,2-dimethyl-1,3-dioxolan-4-yl)ethenyl]-2,2-dimethyl-1,3-dioxolane
CID 18710587
(4S)-4-[(E)-2-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]ethenyl]-2,2-dimethyl-1,3-dioxolane
CID 11053393
4-[(E)-but-1-enyl]-1,3-dioxolan-2-one
CID 23361409
4-[(E)-prop-1-enyl]-1,3-dioxolan-2-one
CID 23361415
4-But-1-enyl-1,3-dioxolan-2-one
CID 54143816
4-Prop-1-enyl-1,3-dioxolan-2-one
CID 54292852
[(1Z)-1-(5-methyl-1,3-dioxolan-4-ylidene)propan-2-yl] propan-2-yl carbonate
CID 57179833
2,5,6,6a-Tetrahydrofuro[3,2-b]furan-6-yl methyl carbonate
CID 57667599
2,2'-spirobi[3aH-cyclohepta[d][1,3]dioxole]
CID 58623512
4-[(2-Oxo-1,3-dioxolan-4-yl)methylidene]-1,3-dioxolan-2-one
CID 59083879

Frequently Asked Questions

What is the IUPAC name of ethene;(4Z)-4-[(2-oxo-1,3-dioxolan-4-yl)methylidene]-1,3-dioxolan-2-one?
The IUPAC name of ethene;(4Z)-4-[(2-oxo-1,3-dioxolan-4-yl)methylidene]-1,3-dioxolan-2-one (CID 159799122) is ethene;(4Z)-4-[(2-oxo-1,3-dioxolan-4-yl)methylidene]-1,3-dioxolan-2-one.
What is the SMILES notation for ethene;(4Z)-4-[(2-oxo-1,3-dioxolan-4-yl)methylidene]-1,3-dioxolan-2-one?
The canonical SMILES for ethene;(4Z)-4-[(2-oxo-1,3-dioxolan-4-yl)methylidene]-1,3-dioxolan-2-one is C=C.O=C1OC/C(=C/C2COC(=O)O2)O1.
What is the InChIKey of ethene;(4Z)-4-[(2-oxo-1,3-dioxolan-4-yl)methylidene]-1,3-dioxolan-2-one?
The InChIKey is NJODCYKPBITEIW-QYUSEIPKSA-N. The full InChI is InChI=1S/C7H6O6.C2H4/c8-6-10-2-4(12-6)1-5-3-11-7(9)13-5;1-2/h1,4H,2-3H2;1-2H2/b5-1-;.
What are the key properties of ethene;(4Z)-4-[(2-oxo-1,3-dioxolan-4-yl)methylidene]-1,3-dioxolan-2-one?
ethene;(4Z)-4-[(2-oxo-1,3-dioxolan-4-yl)methylidene]-1,3-dioxolan-2-one has a molecular weight of 214.17 g/mol, XLogP of 1.37, 1 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for ethene;(4Z)-4-[(2-oxo-1,3-dioxolan-4-yl)methylidene]-1,3-dioxolan-2-one is sourced from PubChem (CID 159799122), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).