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716-61-0

Name D-(-)-THREO-2-AMINO-1-(4-NITROPHENYL)-1,3-PROPANEDIOL
CAS 716-61-0
EINECS(EC#) 211-938-7
Molecular Formula C9H12N2O4
MDL Number MFCD00078126
Molecular Weight 212.2
MOL File 716-61-0.mol
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Chemical Properties

Appearance light yellow powder
Melting point  163-165 °C(lit.)
Boiling point  352.03°C (rough estimate)
density  1.3136 (rough estimate)
refractive index  -30.5 ° (C=1, 6mol/L HCl)
storage temp.  −20°C
solubility  DMSO (Slightly), Methanol (Slightly)
Water Solubility  almost transparency in hot Water
form  Powder
pka 10.98±0.45(Predicted)
color  Light yellow
optical activity [α]25/D 30°, c = 1 in 6 M HCl
InChI InChI=1S/C9H12N2O4/c10-8(5-12)9(13)6-1-3-7(4-2-6)11(14)15/h1-4,8-9,12-13H,5,10H2/t8-,9-/m1/s1
InChIKey OCYJXSUPZMNXEN-RKDXNWHRSA-N
SMILES [C@H](C1=CC=C([N+]([O-])=O)C=C1)(O)[C@H](N)CO

Safety Data

Hazard Codes  Xn,T
Risk Statements 
Safety Statements 
RIDADR  UN 3259 8/PG 3
WGK Germany  3
RTECS  TY3100000
HS Code  29221990

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