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2,4-Dinitroaniline Structure

2,4-Dinitroaniline

Chemical Properties

Melting point 177 °C
Boiling point 316.77°C (rough estimate)
Density  1,61 g/cm3
bulk density 800kg/m3
vapor pressure  <0.001 hPa ( 25 °C)
refractive index  1.6910 (estimate)
Flash point 224 °C
storage temp.  Flammables area
solubility  DMSO (Slightly), Methanol (Slightly)
pka pK1:-14.25(+1) (25°C)
form  Crystalline Powder
color  Yellow to yellow-green or yellow-brown
PH 7 (1g/L in H2O)
Water Solubility  0.06 g/L (20 ºC)
Merck  14,3270
BRN  982999
Henry's Law Constant 6.5×104 mol/(m3Pa) at 25℃, HSDB (2015)
Stability Stable. Incompatible with oxidizing agents. May decompose violently at elevated temperatures.
InChI 1S/C6H5N3O4/c7-5-2-1-4(8(10)11)3-6(5)9(12)13/h1-3H,7H2
InChIKey LXQOQPGNCGEELI-UHFFFAOYSA-N
SMILES Nc1ccc(cc1[N+]([O-])=O)[N+]([O-])=O
CAS DataBase Reference 97-02-9(CAS DataBase Reference)
NIST Chemistry Reference Benzenamine, 2,4-dinitro-(97-02-9)
EPA Substance Registry System 2,4-Dinitroaniline (97-02-9)

Safety Information

Hazard Codes  T+,N
Risk Statements  26/27/28-33-51/53
Safety Statements  28-36/37-45-61-28A
RIDADR  UN 1596 (DINITROANILINES)
WGK Germany  2
RTECS  BX9100000
Autoignition Temperature >365°C
TSCA  TSCA listed
HazardClass  6.1
PackingGroup  II
HS Code  29214210
Storage Class 6.1A - Combustible acute toxic Cat. 1 and 2
very toxic hazardous materials
Hazard Classifications Acute Tox. 1 Dermal
Acute Tox. 2 Inhalation
Acute Tox. 2 Oral
Aquatic Chronic 2
STOT RE 2
Hazardous Substances Data 97-02-9(Hazardous Substances Data)

MSDS

Usage And Synthesis

2,4-Dinitroaniline Supplier