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(Phenylsulfonyl)acetonitrile Structure

(Phenylsulfonyl)acetonitrile

  • Product Name(Phenylsulfonyl)acetonitrile
  • CAS7605-28-9
  • CBNumberCB3473175
  • MFC8H7NO2S
  • MW181.21
  • EINECS231-515-0
  • MDL NumberMFCD00007550
  • MOL File7605-28-9.mol

Chemical Properties

Melting point: 112-114 °C(lit.)
Boiling point: 398.5±34.0 °C(Predicted)
Density  1.284±0.06 g/cm3 (20 ºC 760 Torr)
refractive index  1.5650 (estimate)
storage temp.  Sealed in dry,Room Temperature
solubility  soluble in Methanol
form  powder to crystal
color  White to Almost white
BRN  640716
InChI InChI=1S/C8H7NO2S/c9-6-7-12(10,11)8-4-2-1-3-5-8/h1-5H,7H2
InChIKey ZFCFFNGBCVAUDE-UHFFFAOYSA-N
SMILES C(#N)CS(C1=CC=CC=C1)(=O)=O
CAS DataBase Reference 7605-28-9(CAS DataBase Reference)

Safety

Symbol(GHS)  Skull and Crossbones (GHS06)Skull and Crossbones (GHS06)
GHS06,GHS06
Signal word  Danger
Hazard statements  H301+H311+H331
Precautionary statements  P261-P264-P280-P301+P310-P302+P352+P312-P304+P340+P311
PPE Eyeshields, Faceshields, Gloves, type P2 (EN 143) respirator cartridges
Hazard Codes  T,Xi
Risk Statements  23/24/25-36/37/38
Safety Statements  36/37/39-45-36-26
RIDADR  3276
WGK Germany  3
Hazard Note  Irritant
HazardClass  6.1
PackingGroup  III
HS Code  2930909099
Storage Class 6.1C - Combustible acute toxic Cat.3
toxic compounds or compounds which causing chronic effects
Hazard Classifications Acute Tox. 3 Oral
Limited Quantities 5.0 kg (11 lbs) (solid)
Excepted Quantities Max Inner Pack (30g or 30ml) and Max Outer Pack (1Kg or 1L)
NFPA 704:
1
2 0

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