Methyl Furfuryl Disulfide

• CAS: 57500-00-2
• Catalog Number: ACM57500002
• Category: Furans
• Molecular Weight: 160.3
• Molecular Formula: C6H8OS2
• Synonyms: Furfuryl methyl disulfide
• IUPAC Name: 2-[(Methyldisulfanyl)methyl]furan
• Canonical SMILES: CSSCC1=CC=CO1
• InChI: InChI=1S/C6H8OS2/c1-8-9-5-6-3-2-4-7-6/h2-4H,5H2,1H3
• InChI Key: CLSLQQCDHOZMDT-UHFFFAOYSA-N
• Boiling Point: 60-61 °C
• Flash Point: 194 °F
• Density: 1.162 g/mL at 25 °C(lit.)
• Solubility: Insoluble in water; soluble in organic solvents
• Exact Mass: 160.00165722
• Monoisotopic Mass: 160.00165722
• Odor: Roasted bread crust odor in dilllution
• Physical State: Liquid
• Refractive Index: n20/D 1.568(lit.)
• Storage Conditions: Inert atmosphere,Room Temperature
• Topological Polar Surface Area: 63.7 Ų

Custom Q&A

What is the PubChem CID of Methyl Furfuryl Disulfide?

PubChem CID 62131

What is the molecular formula of Methyl Furfuryl Disulfide?

The molecular formula is C6H8OS2.

What is the molecular weight of Methyl Furfuryl Disulfide?

The molecular weight is 160.3 g/mol.

What is the IUPAC name of Methyl Furfuryl Disulfide?

The IUPAC name is 2-[(methyldisulfanyl)methyl]furan.

What is the InChI of Methyl Furfuryl Disulfide?

The InChI is InChI=1S/C6H8OS2/c1-8-9-5-6-3-2-4-7-6/h2-4H,5H2,1H3.

What is the InChIKey of Methyl Furfuryl Disulfide?

The InChIKey is CLSLQQCDHOZMDT-UHFFFAOYSA-N.

What is the canonical SMILES of Methyl Furfuryl Disulfide?

The canonical SMILES is CSSCC1=CC=CO1.

What is the CAS number of Methyl Furfuryl Disulfide?

The CAS number is 57500-00-2.

What is the XLogP3-AA value of Methyl Furfuryl Disulfide?

The XLogP3-AA value is 1.5.

What is the hydrogen bond donor count of Methyl Furfuryl Disulfide?

The hydrogen bond donor count is 0.