4-[(4-Methylphenyl)thio]-3-nitrobenzaldehyde

Base Information

• Chemical Name: 4-[(4-Methylphenyl)thio]-3-nitrobenzaldehyde
• CAS No.: 270262-89-0
• Molecular Formula: C₁₄H₁₁NO₃S
• Molecular Weight: 273.312
• Hs Code.: 2930909090
• DSSTox Substance ID: DTXSID40352858
• Wikidata: Q82130252
• Mol file: 270262-89-0.mol

Synonyms:270262-89-0;4-[(4-Methylphenyl)thio]-3-nitrobenzaldehyde;4-[(4-methylphenyl)sulfanyl]-3-nitrobenzaldehyde;3-Nitro-4-(p-tolylthio)benzaldehyde;4-(4-methylphenyl)sulfanyl-3-nitrobenzaldehyde;Benzaldehyde, 4-[(4-methylphenyl)thio]-3-nitro-;SCHEMBL5661855;DTXSID40352858;PISSEQSHPLGJCY-UHFFFAOYSA-N;BBL023217;MFCD00098766;STL284489;AKOS000116903;SB85344;3-nitro-4-(p-tolylsulfanyl)benzaldehyde;VS-07356;CS-0221019;FT-0617316;EN300-08156;A818846;Z31253893

Chemical Property of 4-[(4-Methylphenyl)thio]-3-nitrobenzaldehyde

Chemical Property:

• Vapor Pressure: 2.01E-07mmHg at 25°C
• Melting Point: 138 °C
• Boiling Point: 424.8°Cat760mmHg
• Flash Point: 210.7°C
• PSA: 88.19000
• Density: 1.33g/cm³
• LogP: 4.39010
• XLogP3: 3.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 3
• Exact Mass: 273.04596439
• Heavy Atom Count: 19
• Complexity: 323

Purity/Quality:

98%min ^*data from raw suppliers

4-[(4-Methylphenyl)thio]-3-nitrobenzaldehyde 95% ^*data from reagent suppliers

Safty Information:

• Hazard Codes: Xi
• Safety Statements: S24/25:Avoid contact with skin and eyes.

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC=C(C=C1)SC2=C(C=C(C=C2)C=O)[N+](=O)[O-]