(Z)-1-ethenoxyethene-1,2-dithiol

C4H6OS2 — CID 141496265

IUPAC(Z)-1-ethenoxyethene-1,2-dithiol
SMILESC=CO/C(S)=C/S
InChIInChI=1S/C4H6OS2/c1-2-5-4(7)3-6/h2-3,6-7H,1H2/b4-3-
InChIKeyGZVXHRHPSSWOSQ-ARJAWSKDSA-N
MW134.22 g/mol
LogP1.80
Rot. Bonds2

About (Z)-1-ethenoxyethene-1,2-dithiol

(Z)-1-ethenoxyethene-1,2-dithiol (PubChem CID 141496265) has the molecular formula C4H6OS2 and a molecular weight of 134.22 g/mol. Its IUPAC name is (Z)-1-ethenoxyethene-1,2-dithiol.

Molecular Properties

Compound Name(Z)-1-ethenoxyethene-1,2-dithiol
PubChem CID141496265
Molecular FormulaC4H6OS2
Molecular Weight134.22 g/mol
Exact Mass133.99
IUPAC Name(Z)-1-ethenoxyethene-1,2-dithiol
SMILESC=CO/C(S)=C/S
InChIInChI=1S/C4H6OS2/c1-2-5-4(7)3-6/h2-3,6-7H,1H2/b4-3-
InChIKeyGZVXHRHPSSWOSQ-ARJAWSKDSA-N
XLogP1.80
TPSA9.23 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500134.22
LogP ≤ 51.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'thiol_2', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (Z)-1-ethenoxyethene-1,2-dithiol?
The IUPAC name of (Z)-1-ethenoxyethene-1,2-dithiol (CID 141496265) is (Z)-1-ethenoxyethene-1,2-dithiol.
What is the SMILES notation for (Z)-1-ethenoxyethene-1,2-dithiol?
The canonical SMILES for (Z)-1-ethenoxyethene-1,2-dithiol is C=CO/C(S)=C/S.
What is the InChIKey of (Z)-1-ethenoxyethene-1,2-dithiol?
The InChIKey is GZVXHRHPSSWOSQ-ARJAWSKDSA-N. The full InChI is InChI=1S/C4H6OS2/c1-2-5-4(7)3-6/h2-3,6-7H,1H2/b4-3-.
What are the key properties of (Z)-1-ethenoxyethene-1,2-dithiol?
(Z)-1-ethenoxyethene-1,2-dithiol has a molecular weight of 134.22 g/mol, XLogP of 1.80, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-1-ethenoxyethene-1,2-dithiol is sourced from PubChem (CID 141496265), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).