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4-Chlorophenyl isothiocyanate Structure

4-Chlorophenyl isothiocyanate

  • Product Name4-Chlorophenyl isothiocyanate
  • CAS2131-55-7
  • CBNumberCB2274405
  • MFC7H4ClNS
  • MW169.63
  • EINECS218-358-3
  • MDL NumberMFCD00004810
  • MOL File2131-55-7.mol

Chemical Properties

Melting point: 42-44 °C(lit.)
Boiling point: 135-136 °C24 mm Hg(lit.)
Density  1.3181 (rough estimate)
refractive index  1.6100 (estimate)
Flash point: 110 °C
storage temp.  Refrigerator (+4°C)
form  powder to crystal
color  White to Light yellow
Sensitive  Moisture Sensitive
BRN  471610
InChI InChI=1S/C7H4ClNS/c8-6-1-3-7(4-2-6)9-5-10/h1-4H
InChIKey MZZVFXMTZTVUFO-UHFFFAOYSA-N
SMILES C1(Cl)=CC=C(N=C=S)C=C1
CAS DataBase Reference 2131-55-7(CAS DataBase Reference)

Safety

Symbol(GHS)  Skull and Crossbones (GHS06)Health Hazard (GHS08)
GHS06,GHS08
Signal word  Danger
Hazard statements  H301+H311+H331-H315-H317-H319-H334-H335
Precautionary statements  P261-P280-P301+P310-P302+P352+P312-P304+P340+P311-P305+P351+P338
target organs Respiratory system
PPE Eyeshields, Faceshields, Gloves, type P2 (EN 143) respirator cartridges
Hazard Codes  T
Risk Statements  23/24-36/37/38-42-42/43-23/24/25
Safety Statements  22-26-36/37/39-45-36/37
RIDADR  UN 2206 6.1/PG 2
WGK Germany  3
RTECS  NX8473000
F  10-21-19
HazardClass  8
PackingGroup  III
HS Code  29309090
Storage Class 6.1C - Combustible acute toxic Cat.3
toxic compounds or compounds which causing chronic effects
Hazard Classifications Acute Tox. 3 Dermal
Acute Tox. 3 Inhalation
Acute Tox. 3 Oral
Eye Irrit. 2
Resp. Sens. 1
Skin Irrit. 2
Skin Sens. 1
STOT SE 3
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
3 0

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4-Chlorophenyl isothiocyanate Chemical Properties,Usage,Production

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