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30007-47-7

Name 5-Bromo-5-nitro-1,3-dioxane
CAS 30007-47-7
EINECS(EC#) 250-001-7
Molecular Formula C4H6BrNO4
MDL Number MFCD00101855
Molecular Weight 212
MOL File 30007-47-7.mol

Chemical Properties

Melting point  58-60 °C
Boiling point  280.8±40.0 °C(Predicted)
density  1.070
vapor pressure  1.6Pa at 20℃
refractive index  1.6200 (estimate)
storage temp.  Refrigerator
solubility  DMF: 30 mg/ml; DMSO: 30 mg/ml; DMSO:PBS(pH 7.2) (1:4): 0.2 mg/ml; Ethanol: 25 mg/ml
form  neat
color  White to Almost white
Water Solubility  Soluble in water at 12.5mg/ml
InChI InChI=1S/C4H6BrNO4/c5-4(6(7)8)1-9-3-10-2-4/h1-3H2
InChIKey XVBRCOKDZVQYAY-UHFFFAOYSA-N
SMILES O1CC(Br)([N+]([O-])=O)COC1
LogP 1.6 at 23℃
CAS DataBase Reference 30007-47-7(CAS DataBase Reference)
NIST Chemistry Reference 1,3-Dioxane, 5-bromo-5-nitro-(30007-47-7)
EPA Substance Registry System 30007-47-7(EPA Substance)

Safety Data

Hazard Codes  Xn
Risk Statements 
R22:Harmful if swallowed.
R38:Irritating to the skin.
Safety Statements 
S36:Wear suitable protective clothing .
RIDADR  1759
WGK Germany  3
RTECS  JG9650000
TSCA  Yes
HS Code  29329990

Hazard Information

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