4-Methyl-3,5-dinitrobenzyl alcohol

Base Information

• Chemical Name: 4-Methyl-3,5-dinitrobenzyl alcohol
• CAS No.: 171809-20-4
• Molecular Formula: C₈H₈N₂O₅
• Molecular Weight: 212.162
• Hs Code.: 2906299090
• DSSTox Substance ID: DTXSID30401743
• Wikidata: Q82204971
• Mol file: 171809-20-4.mol

Synonyms:4-Methyl-3,5-dinitrobenzyl alcohol;171809-20-4;(4-methyl-3,5-dinitrophenyl)methanol;4-METHYL-3 5-DINITROBENZYL ALCOHOL 96;SCHEMBL1667914;DTXSID30401743;CFABPPYLLXJWIW-UHFFFAOYSA-N;4-Methyl-3,5-dinitrobenzylalcohol;AKOS022173724;4-Methyl-3,5-dinitrobenzyl alcohol, 96%;J-010760

Chemical Property of 4-Methyl-3,5-dinitrobenzyl alcohol

Chemical Property:

• Vapor Pressure: 6.56E-07mmHg at 25°C
• Melting Point: 57-61 °C(lit.)
• Refractive Index: 1.624
• Boiling Point: 393.8°C at 760 mmHg
• Flash Point: 175.4°C
• PSA: 111.87000
• Density: 1.481g/cm³
• LogP: 2.35010
• XLogP3: 1.1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 1
• Exact Mass: 212.04332136
• Heavy Atom Count: 15
• Complexity: 235

Purity/Quality:

97% ^*data from raw suppliers

4-Methyl-3,5-dinitrobenzyl alcohol ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

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