77-49-6

Name 2-METHYL-2-NITRO-1,3-PROPANEDIOL
CAS 77-49-6
EINECS(EC#) 201-031-4
Molecular Formula C4H9NO4
MDL Number MFCD00024812
Molecular Weight 135.12
MOL File 77-49-6.mol
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Chemical Properties

Appearance white to yellowish crystals
Melting point  147-149 °C
Boiling point  248.79°C (rough estimate)
density  1.4474 (rough estimate)
refractive index  1.4183 (estimate)
Water Solubility  Soluble in water
form  powder to crystal
pka 12.86±0.10(Predicted)
color  White to Almost white
InChI InChI=1S/C4H9NO4/c1-4(2-6,3-7)5(8)9/h6-7H,2-3H2,1H3
InChIKey LOTYADDQWWVBDJ-UHFFFAOYSA-N
SMILES C(O)C(C)([N+]([O-])=O)CO
Uses
Intermediate.
CAS DataBase Reference 77-49-6(CAS DataBase Reference)
EPA Substance Registry System 2-Methyl-2-nitro-1,3-propanediol (77-49-6)

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
Risk Statements 
R36/37/38:Irritating to eyes, respiratory system and skin .
Safety Statements 
S24/25:Avoid contact with skin and eyes .
RTECS  TY8925000
TSCA  Yes
HS Code  29053995

Hazard Information

Spectrum Detail

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