1041026-55-4

Name (3-(BroMoMethyl)-1-(p-toluenesulfonyl)azetidin-3-yl)Methanol
CAS 1041026-55-4
Molecular Formula C12H16BrNO3S
MDL Number MFCD18782897
Molecular Weight 334.229
MOL File 1041026-55-4.mol
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Chemical Properties

Melting point  85-88 °C
Boiling point  462.7±51.0 °C(Predicted)
density  1.541±0.06 g/cm3(Predicted)
storage temp.  Sealed in dry,2-8°C
form  solid
pka 14.82±0.10(Predicted)
color  White
InChI InChI=1S/C12H16BrNO3S/c1-10-2-4-11(5-3-10)18(16,17)14-7-12(6-13,8-14)9-15/h2-5,15H,6-9H2,1H3
InChIKey KQQMWQUXNMGDNO-UHFFFAOYSA-N
SMILES N1(S(C2=CC=C(C)C=C2)(=O)=O)CC(CBr)(CO)C1

Safety Data

Risk Statements 
Safety Statements 
RIDADR  UN 2811 6.1 / PGIII
WGK Germany  WGK 3
HS Code  2933998090
Storage Class 6.1C - Combustible acute toxic Cat.3
toxic compounds or compounds which causing chronic effects
Hazard Classifications Acute Tox. 3 Oral
Eye Irrit. 2

Spectrum Detail

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