618-95-1

Name Methyl 3-nitrobenzoate
CAS 618-95-1
EINECS(EC#) 210-573-0
Molecular Formula C8H7NO4
MDL Number MFCD00007250
Molecular Weight 181.15
MOL File 618-95-1.mol
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Chemical Properties

Appearance beige crystalline powder
Melting point  78-80 °C (lit.)
Boiling point  279 °C (lit.)
density  1.4283 (rough estimate)
refractive index  1.5468 (estimate)
Fp  279°C
storage temp.  Sealed in dry,Room Temperature
form  Crystalline Powder
color  Beige
Stability: Stable. Incompatible with strong oxidizing agents.
Water Solubility  insoluble
BRN  392449
InChI 1S/C8H7NO4/c1-13-8(10)6-3-2-4-7(5-6)9(11)12/h2-5H,1H3
InChIKey AXLYJLKKPUICKV-UHFFFAOYSA-N
SMILES COC(=O)c1cccc(c1)[N+]([O-])=O
CAS DataBase Reference 618-95-1(CAS DataBase Reference)
NIST Chemistry Reference 3-O2N-C6H4-COOCH3(618-95-1)
EPA Substance Registry System 618-95-1(EPA Substance)

Safety Data

Symbol(GHS)  Exclamation Mark (GHS07)
GHS07
Signal word  Warning
Hazard statements  H302-H315-H319-H335
Precautionary statements  P261-P305+P351+P338
Safety Statements 
S24/25:Avoid contact with skin and eyes .
WGK Germany  3
TSCA  Yes
HS Code  29163900
Storage Class 11 - Combustible Solids

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