Bicyclo[4.2.0]octa-1,3,5-triene-7-carboxylicacid , 98% , 14381-41-0

CAS NO.：14381-41-0

Empirical Formula: C9H8O2

Molecular Weight: 148.16

MDL number: MFCD00001351

PRODUCT Properties

• Melting point: 75-77 °C (lit.)
• Boiling point: 318.6±31.0 °C(Predicted)
• Density: 1.310±0.06 g/cm3(Predicted)
• storage temp.: Sealed in dry,Room Temperature
• pka: 4.18±0.20(Predicted)
• form: Crystalline Powder or Powder
• color: White to pale brown
• InChI: InChI=1S/C9H8O2/c10-9(11)8-5-6-3-1-2-4-7(6)8/h1-4,8H,5H2,(H,10,11)
• InChIKey: NYOXTUZNVYEODT-UHFFFAOYSA-N
• SMILES: C12C(C(C(O)=O)C1)=CC=CC=2

Description and Uses

1-Benzocyclobutenecarboxylic acid is a dynamic building block, capable of taking part in Diels-Alder reactions, and has been used to create large compounds such as cyclohexylmethylpiperidinyltriphenylpropioamide, a highly selective M3 antagonist.

Safety

• Symbol(GHS): GHS07
• Signal word: Warning
• Hazard statements: H315-H319-H335
• Precautionary statements: P261-P264-P271-P280-P302+P352-P305+P351+P338
• Hazard Codes: Xi
• Risk Statements: 36/37/38
• Safety Statements: 26-37/39
• WGK Germany: 3