(Z)-3-(1,3-benzodioxol-5-yl)-2-sulfanylprop-2-enoic acid

Base Information

• Chemical Name: (Z)-3-(1,3-benzodioxol-5-yl)-2-sulfanylprop-2-enoic acid
• CAS No.: 5765-88-8
• Molecular Formula: C₁₀H₈O₄S
• Molecular Weight: 224.237
• NSC Number: 108941
• Mol file: 5765-88-8.mol

Synonyms:NSC108941;5765-88-8;NSC-108941

Chemical Property of (Z)-3-(1,3-benzodioxol-5-yl)-2-sulfanylprop-2-enoic acid

Chemical Property:

• Vapor Pressure: 1.71E-07mmHg at 25°C
• Boiling Point: 411°Cat760mmHg
• Flash Point: 202.4°C
• Density: 1.494g/cm³
• XLogP3: 2.4
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 2
• Exact Mass: 224.01432991
• Heavy Atom Count: 15
• Complexity: 289

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1OC2=C(O1)C=C(C=C2)C=C(C(=O)O)S
• Isomeric SMILES: C1OC2=C(O1)C=C(C=C2)/C=C(/C(=O)O)\S