3-(methyldisulfanyl)-2,3-dihydrofuran

C5H8OS2 — CID 90692983

IUPAC3-(methyldisulfanyl)-2,3-dihydrofuran
SMILESCSSC1C=COC1
InChIInChI=1S/C5H8OS2/c1-7-8-5-2-3-6-4-5/h2-3,5H,4H2,1H3
InChIKeyFRMFDKHYKCPAKE-UHFFFAOYSA-N
MW148.25 g/mol
LogP1.91
Rot. Bonds2

About 3-(methyldisulfanyl)-2,3-dihydrofuran

3-(methyldisulfanyl)-2,3-dihydrofuran (PubChem CID 90692983) has the molecular formula C5H8OS2 and a molecular weight of 148.25 g/mol. Its IUPAC name is 3-(methyldisulfanyl)-2,3-dihydrofuran.

Molecular Properties

Compound Name3-(methyldisulfanyl)-2,3-dihydrofuran
PubChem CID90692983
Molecular FormulaC5H8OS2
Molecular Weight148.25 g/mol
Exact Mass148.00
IUPAC Name3-(methyldisulfanyl)-2,3-dihydrofuran
SMILESCSSC1C=COC1
InChIInChI=1S/C5H8OS2/c1-7-8-5-2-3-6-4-5/h2-3,5H,4H2,1H3
InChIKeyFRMFDKHYKCPAKE-UHFFFAOYSA-N
XLogP1.91
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500148.25
LogP ≤ 51.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 3-(methyldisulfanyl)-2,3-dihydrofuran 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

2-Methyl-2,3-dihydrofuran-3-thiol
CID 524174
2,3-Dihydrofuranyl ethyl sulfide
CID 129671338
2-Methyl-2-(methyl dithio}furan
CID 129681576
2,3-Dihydrofuran-2-thiol
CID 18319468
2,3-Dihydrofuran-3-thiol
CID 21401493
3-Penta-1,4-dienoxypropane-1-thiolate;rutherfordium
CID 59029816
2-Penta-1,4-dienoxyethanethiolate;rutherfordium
CID 59029818
2-Methylsulfanyl-2,3-dihydrofuran
CID 66827287
4-(4-Sulfanylbut-1-enoxy)but-3-ene-1-thiol
CID 91112274
3-Methylsulfanyl-2,3-dihydrofuran
CID 123921746
2-(Sulfanylmethyl)-2,3-dihydrofuran-3-thiol
CID 170360346
1-[2-(Disulfanyl)ethoxy]prop-1-ene
CID 173636208

Frequently Asked Questions

What is the IUPAC name of 3-(methyldisulfanyl)-2,3-dihydrofuran?
The IUPAC name of 3-(methyldisulfanyl)-2,3-dihydrofuran (CID 90692983) is 3-(methyldisulfanyl)-2,3-dihydrofuran.
What is the SMILES notation for 3-(methyldisulfanyl)-2,3-dihydrofuran?
The canonical SMILES for 3-(methyldisulfanyl)-2,3-dihydrofuran is CSSC1C=COC1.
What is the InChIKey of 3-(methyldisulfanyl)-2,3-dihydrofuran?
The InChIKey is FRMFDKHYKCPAKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H8OS2/c1-7-8-5-2-3-6-4-5/h2-3,5H,4H2,1H3.
What are the key properties of 3-(methyldisulfanyl)-2,3-dihydrofuran?
3-(methyldisulfanyl)-2,3-dihydrofuran has a molecular weight of 148.25 g/mol, XLogP of 1.91, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(methyldisulfanyl)-2,3-dihydrofuran is sourced from PubChem (CID 90692983), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).