(4E)-4-ethylidene-1,3-dioxolan-2-one

C5H6O3 — CID 19050566

IUPAC(4E)-4-ethylidene-1,3-dioxolan-2-one
SMILESC/C=C1\COC(=O)O1
InChIInChI=1S/C5H6O3/c1-2-4-3-7-5(6)8-4/h2H,3H2,1H3/b4-2+
InChIKeySGNPYKFRFLHQPC-DUXPYHPUSA-N
MW114.10 g/mol
LogP1.06
Rot. Bonds

About (4E)-4-ethylidene-1,3-dioxolan-2-one

(4E)-4-ethylidene-1,3-dioxolan-2-one (PubChem CID 19050566) has the molecular formula C5H6O3 and a molecular weight of 114.10 g/mol. Its IUPAC name is (4E)-4-ethylidene-1,3-dioxolan-2-one.

Molecular Properties

Compound Name(4E)-4-ethylidene-1,3-dioxolan-2-one
PubChem CID19050566
Molecular FormulaC5H6O3
Molecular Weight114.10 g/mol
Exact Mass114.03
IUPAC Name(4E)-4-ethylidene-1,3-dioxolan-2-one
SMILESC/C=C1\COC(=O)O1
InChIInChI=1S/C5H6O3/c1-2-4-3-7-5(6)8-4/h2H,3H2,1H3/b4-2+
InChIKeySGNPYKFRFLHQPC-DUXPYHPUSA-N
XLogP1.06
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500114.10
LogP ≤ 51.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze (4E)-4-ethylidene-1,3-dioxolan-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-Methylene-1,3-dioxolan-2-one
CID 13157020
Ethylidene ethylene carbonate
CID 68503227
(4E)-4-[[(E)-prop-1-enoxy]methylidene]-1,3-dioxolan-2-one
CID 17773906
4-Propan-2-ylidene-1,3-dioxolan-2-one
CID 19050565
4-(Methoxymethyl)-1,3-dioxol-2-one
CID 20537317
Mexartan Potassium Impurity 180
CID 21362368
4-(Prop-1-enoxymethylidene)-1,3-dioxolan-2-one
CID 54105154
4-Methyl-5-(prop-1-en-2-yloxymethyl)-1,3-dioxol-2-one
CID 58840443
4-Ethylidene-1,3-dioxolane
CID 68432538
4-Ethylidene-1,3-dioxolan-2-one
CID 68503228
6-methyl-4H-1,3-dioxin-2-one
CID 69479038
4-Prop-2-enylidene-1,3-dioxolan-2-one
CID 89826907

Frequently Asked Questions

What is the IUPAC name of (4E)-4-ethylidene-1,3-dioxolan-2-one?
The IUPAC name of (4E)-4-ethylidene-1,3-dioxolan-2-one (CID 19050566) is (4E)-4-ethylidene-1,3-dioxolan-2-one.
What is the SMILES notation for (4E)-4-ethylidene-1,3-dioxolan-2-one?
The canonical SMILES for (4E)-4-ethylidene-1,3-dioxolan-2-one is C/C=C1\COC(=O)O1.
What is the InChIKey of (4E)-4-ethylidene-1,3-dioxolan-2-one?
The InChIKey is SGNPYKFRFLHQPC-DUXPYHPUSA-N. The full InChI is InChI=1S/C5H6O3/c1-2-4-3-7-5(6)8-4/h2H,3H2,1H3/b4-2+.
What are the key properties of (4E)-4-ethylidene-1,3-dioxolan-2-one?
(4E)-4-ethylidene-1,3-dioxolan-2-one has a molecular weight of 114.10 g/mol, XLogP of 1.06, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4E)-4-ethylidene-1,3-dioxolan-2-one is sourced from PubChem (CID 19050566), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).