1975-50-4

Name 2-Methyl-3-nitrobenzoic acid
CAS 1975-50-4
EINECS(EC#) 217-826-4
Molecular Formula C8H7NO4
MDL Number MFCD00007160
Molecular Weight 181.15
MOL File 1975-50-4.mol

Chemical Properties

Appearance white crystal powder
Melting point  182-184 °C (lit.)
Boiling point  314.24°C (rough estimate)
density  1.4283 (rough estimate)
refractive index  1.5468 (estimate)
storage temp.  Sealed in dry,Room Temperature
form  powder to crystal
pka 3.03±0.20(Predicted)
color  White to Light red to Green
Water Solubility  <0.1 g/100 mL at 22 ºC
BRN  2050096
InChI InChI=1S/C8H7NO4/c1-5-6(8(10)11)3-2-4-7(5)9(12)13/h2-4H,1H3,(H,10,11)
InChIKey YPQAFWHSMWWPLX-UHFFFAOYSA-N
SMILES C(O)(=O)C1=CC=CC([N+]([O-])=O)=C1C
CAS DataBase Reference 1975-50-4(CAS DataBase Reference)
EPA Substance Registry System 1975-50-4(EPA Substance)

Safety Data

Symbol(GHS)  Exclamation Mark (GHS07)
GHS07
Signal word  Warning
Hazard statements  H315-H319-H335
Precautionary statements  P261-P280a-P304+P340-P305+P351+P338-P405-P501a
Hazard Codes  Xi,Xn
Risk Statements 
R36/37/38:Irritating to eyes, respiratory system and skin .
R20/21/22:Harmful by inhalation, in contact with skin and 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 .
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection .
S22:Do not breathe dust .
WGK Germany  3
Hazard Note  Irritant
TSCA  Yes
HS Code  29163900
Storage Class 11 - Combustible Solids

Hazard Information

Material Safety Data Sheet(MSDS)

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