121-81-3

Name 3,5-Dinitrobenzamide
CAS 121-81-3
EINECS(EC#) 204-499-8
Molecular Formula C7H5N3O5
MDL Number MFCD00007985
Molecular Weight 211.13
MOL File 121-81-3.mol
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Chemical Properties

Appearance light yellow powder
Melting point  183-185 °C (lit.)
Boiling point  350.8°C (rough estimate)
density  1.6444 (rough estimate)
refractive index  1.5500 (estimate)
storage temp.  Store at -20°C
solubility  DMSO : ≥ 2.2 mg/mL (10.42 mM)
form  neat
pka 13.73±0.50(Predicted)
color  Light yellow to yellow
Merck  14,6612
BRN  7096825
InChI 1S/C7H5N3O5/c8-7(11)4-1-5(9(12)13)3-6(2-4)10(14)15/h1-3H,(H2,8,11)
InChIKey UUKWKUSGGZNXGA-UHFFFAOYSA-N
SMILES NC(=O)c1cc(cc(c1)[N+]([O-])=O)[N+]([O-])=O
CAS DataBase Reference 121-81-3(CAS DataBase Reference)
NIST Chemistry Reference 3,5-Dinitrobenzamide(121-81-3)
EPA Substance Registry System 121-81-3(EPA Substance)

Safety Data

Hazard Codes  Xn
Risk Statements 
R22:Harmful if swallowed.
Safety Statements 
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36:Wear suitable protective clothing .
WGK Germany  3
RTECS  CV4752300
HS Code  29242990
Storage Class 13 - Non Combustible Solids
Hazard Classifications Acute Tox. 4 Oral

Hazard Information

Material Safety Data Sheet(MSDS)

Spectrum Detail

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