3125-77-7

Name 1 3-PHENYLENE DIISOTHIOCYANATE 97
CAS 3125-77-7
Molecular Formula C8H4N2S2
MDL Number MFCD01716878
Molecular Weight 192.26
MOL File 3125-77-7.mol
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Chemical Properties

Melting point  56 °C (dec.) (lit.)
Boiling point  358.8±25.0 °C(Predicted)
density  1.3675 (rough estimate)
refractive index  1.6000 (estimate)
storage temp.  2-8°C
form  solid
Water Solubility  3.845mg/L(25 ºC)
InChI 1S/C8H4N2S2/c11-5-9-7-2-1-3-8(4-7)10-6-12/h1-4H
InChIKey BOLANQNHTGVOMY-UHFFFAOYSA-N
SMILES S=C=Nc1cccc(c1)N=C=S

Safety Data

Hazard Codes  Xn
Risk Statements 
Safety Statements 
RIDADR  UN 3335
WGK Germany  3
RTECS  NX9160000
Storage Class 11 - Combustible Solids
Hazard Classifications Acute Tox. 4 Oral
Eye Irrit. 2
Resp. Sens. 1
Skin Irrit. 2
STOT SE 3

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