4-Acetyl-2-nitrobenzaldehyde

Base Information

• Chemical Name: 4-Acetyl-2-nitrobenzaldehyde
• CAS No.: 933443-35-7
• Molecular Formula: C₉H₇NO₄
• Molecular Weight: 193.159
• Hs Code.: 2914400090
• DSSTox Substance ID: DTXSID80581605
• Wikidata: Q82472791
• Mol file: 933443-35-7.mol

Synonyms:4-Acetyl-2-nitrobenzaldehyde;933443-35-7;SCHEMBL25590305;DTXSID80581605;AKOS006313064

Chemical Property of 4-Acetyl-2-nitrobenzaldehyde

Chemical Property:

• Vapor Pressure: 0.000103mmHg at 25°C
• Boiling Point: 337.7°C at 760 mmHg
• Flash Point: 167.7°C
• PSA: 79.96000
• Density: 1.337g/cm³
• LogP: 2.13310
• XLogP3: 1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 2
• Exact Mass: 193.03750770
• Heavy Atom Count: 14
• Complexity: 258

Purity/Quality:

≥99% ^*data from raw suppliers

4-Acetyl-2-nitrobenzaldehyde 95+% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(=O)C1=CC(=C(C=C1)C=O)[N+](=O)[O-]

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