4-Chloro-1,2-benzisoxazol-3(2H)-one

Base Information

• Chemical Name: 4-Chloro-1,2-benzisoxazol-3(2H)-one
• CAS No.: 178748-22-6
• Molecular Formula: C7H4ClNO2
• Molecular Weight: 169.57
• Hs Code.: 2934999090
• DSSTox Substance ID: DTXSID90595657
• Wikidata: Q72517205
• Mol file: 178748-22-6.mol

Synonyms:178748-22-6;4-Chloro-1,2-benzisoxazol-3(2H)-one;4-chloro-1,2-benzoxazol-3-one;1,2-Benzisoxazol-3(2H)-one, 4-chloro-;4-chlorobenzo[d]isoxazol-3(2H)-one;4-chloro-2,3-dihydro-1,2-benzoxazol-3-one;1,2-Benzisoxazol-3(2H)-one,4-chloro-;SCHEMBL4718762;DTXSID90595657;BCP27390;chloro-3-hydroxy-1,2-benzisoxazole;AKOS005146113;4-Chloro-1,2-benzoxazol-3(2H)-one;AC-7661;A3963

Chemical Property of 4-Chloro-1,2-benzisoxazol-3(2H)-one

Chemical Property:

• Vapor Pressure: 5.65E-05mmHg at 25°C
• Refractive Index: 1.673
• Boiling Point: 336.7 °C at 760 mmHg
• Flash Point: 157.4 °C
• PSA: 46.00000
• Density: 1.486g/cm³
• LogP: 1.77450
• Storage Temp.: 2-8°C
• XLogP3: 1.8
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 0
• Exact Mass: 168.9930561
• Heavy Atom Count: 11
• Complexity: 185

Purity/Quality:

98%,99%, ^*data from raw suppliers

4-Chloro-1,2-benzisoxazol-3(2H)-one 97% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC2=C(C(=C1)Cl)C(=O)NO2