2-(Chloromethyl)-1-(1-methylpropyl)-4-nitrobenzene

Base Information

• Chemical Name: 2-(Chloromethyl)-1-(1-methylpropyl)-4-nitrobenzene
• CAS No.: 68015-95-2
• Molecular Formula: C11H14ClNO2
• Molecular Weight: 227.6874
• European Community (EC) Number: 268-161-1
• DSSTox Substance ID: DTXSID90887120
• Nikkaji Number: J287.802J
• Mol file: 68015-95-2.mol

Synonyms:2-sec-Butyl-5-nitrobenzyl chloride;68015-95-2;2-(Chloromethyl)-1-(1-methylpropyl)-4-nitrobenzene;EINECS 268-161-1;Benzene, 2-(chloromethyl)-1-(1-methylpropyl)-4-nitro-;DTXSID90887120;2-Chloromethyl-1-(1-methylpropyl)-4-nitrobenzene

Chemical Property of 2-(Chloromethyl)-1-(1-methylpropyl)-4-nitrobenzene

Chemical Property:

• Vapor Pressure: 0.000303mmHg at 25°C
• Boiling Point: 331.3°Cat760mmHg
• Flash Point: 154.2°C
• PSA: 45.82000
• Density: 1.164g/cm³
• LogP: 4.37030
• XLogP3: 3.8
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 227.0713064
• Heavy Atom Count: 15
• Complexity: 217

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

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

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