52434-90-9

Name Hexahydro-1,3,5-tris(2,3-dibromopropyl)-1,3,5-triazine-2,4,6-trione
CAS 52434-90-9
EINECS(EC#) 257-913-4
Molecular Formula C12H15Br6N3O3
MDL Number MFCD00010290
Molecular Weight 728.69
MOL File 52434-90-9.mol

Chemical Properties

Melting point  110 °C
Boiling point  618.8±55.0 °C(Predicted)
density  2.338±0.06 g/cm3(Predicted)
vapor pressure  0Pa at 20℃
solubility  Soluble in chloroform.
form  powder to crystal
pka -2.72±0.20(Predicted)
color  White to Almost white
Water Solubility  5.07mg/L at 20℃
Henry's Law Constant 8.2×1012 mol/(m3Pa) at 25℃, Zhang et al. (2010)
Stability: Light Sensitive
InChI InChI=1S/C12H15Br6N3O3/c13-1-7(16)4-19-10(22)20(5-8(17)2-14)12(24)21(11(19)23)6-9(18)3-15/h7-9H,1-6H2
InChIKey NZUPFZNVGSWLQC-UHFFFAOYSA-N
SMILES N1(CC(Br)CBr)C(=O)N(CC(Br)CBr)C(=O)N(CC(Br)CBr)C1=O
LogP 7.37
CAS DataBase Reference 52434-90-9(CAS DataBase Reference)
EPA Substance Registry System 52434-90-9(EPA Substance)

Safety Data

Hazard Codes  Xi
Risk Statements 
R36/37/38:Irritating to eyes, respiratory system and skin .
Safety Statements 
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S37/39:Wear suitable gloves and eye/face protection .
WGK Germany  2
TSCA  TSCA listed
REACH Registrations Active
HS Code  29336990
Storage Class 11 - Combustible Solids
Hazard Classifications Eye Irrit. 2
Skin Irrit. 2
STOT SE 3

Hazard Information

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