(E)-1-methylsulfanylprop-1-ene

C4H8S — CID 637915

About (E)-1-methylsulfanylprop-1-ene

(E)-1-methylsulfanylprop-1-ene (PubChem CID 637915) has the molecular formula C4H8S and a molecular weight of 88.17 g/mol. Its IUPAC name is (E)-1-methylsulfanylprop-1-ene.

Molecular Properties

• Compound Name: (E)-1-methylsulfanylprop-1-ene
• PubChem CID: 637915
• Molecular Formula: C4H8S
• Molecular Weight: 88.17 g/mol
• Exact Mass: 88.03
• IUPAC Name: (E)-1-methylsulfanylprop-1-ene
• SMILES: C/C=C/SC
• InChI: InChI=1S/C4H8S/c1-3-4-5-2/h3-4H,1-2H3/b4-3+
• InChIKey: YJOGCMRDEUBRJD-ONEGZZNKSA-N
• XLogP: 1.88
• TPSA: 0.00 Ų
• H-Bond Acceptors: 1
• Rotatable Bonds: 1
• Heavy Atoms: 5
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	88.17
LogP ≤ 5	1.88
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	1

Frequently Asked Questions

What is the IUPAC name of (E)-1-methylsulfanylprop-1-ene?

The IUPAC name of (E)-1-methylsulfanylprop-1-ene (CID 637915) is (E)-1-methylsulfanylprop-1-ene.

What is the SMILES notation for (E)-1-methylsulfanylprop-1-ene?

The canonical SMILES for (E)-1-methylsulfanylprop-1-ene is C/C=C/SC.

What is the InChIKey of (E)-1-methylsulfanylprop-1-ene?

The InChIKey is YJOGCMRDEUBRJD-ONEGZZNKSA-N. The full InChI is InChI=1S/C4H8S/c1-3-4-5-2/h3-4H,1-2H3/b4-3+.

What are the key properties of (E)-1-methylsulfanylprop-1-ene?

(E)-1-methylsulfanylprop-1-ene has a molecular weight of 88.17 g/mol, XLogP of 1.88, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.

Where does this data come from?

All data for (E)-1-methylsulfanylprop-1-ene is sourced from PubChem (CID 637915), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).