3-(2-Bromophenyl)isoxazole-5-carbaldehyde

Base Information

• Chemical Name: 3-(2-Bromophenyl)isoxazole-5-carbaldehyde
• CAS No.: 869496-61-7
• Molecular Formula: C10H6 Br N O2
• Molecular Weight: 252.06
• Hs Code.: 2934999090
• DSSTox Substance ID: DTXSID70587414
• Wikidata: Q82479832
• Mol file: 869496-61-7.mol

Synonyms:869496-61-7;3-(2-Bromophenyl)isoxazole-5-carbaldehyde;3-(2-BROMO-PHENYL)-ISOXAZOLE-5-CARBALDEHYDE;3-(2-BROMOPHENYL)-1,2-OXAZOLE-5-CARBALDEHYDE;DTXSID70587414;AB27301;DB-076788;5-Isoxazolecarboxaldehyde, 3-(2-bromophenyl)-;EN300-380596;A862969

Chemical Property of 3-(2-Bromophenyl)isoxazole-5-carbaldehyde

Chemical Property:

• PSA: 43.10000
• LogP: 2.91660
• XLogP3: 2.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 250.95819
• Heavy Atom Count: 14
• Complexity: 212

Purity/Quality:

98%min ^*data from raw suppliers

3-(2-bromophenyl)isoxazole-5-carbaldehyde 95% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C(=C1)C2=NOC(=C2)C=O)Br