3,5-Dichlorophenyl isocyanate Structure

3,5-Dichlorophenyl isocyanate

Chemical Properties

Melting point 32-34 °C (lit.)
Boiling point 243 °C
Density  1.38 g/mL at 25 °C (lit.)
vapor pressure  4.7-8.1Pa at 25℃
refractive index  1.6000 (estimate)
Flash point >230 °F
storage temp.  -20°C Freezer
solubility  decomposes
form  Low Melting Solid
color  White to slightly yellow
Water Solubility  decomposes
Sensitive  Moisture Sensitive
BRN  510282
Henry's Law Constant 7.7×10-2 mol/(m3Pa) at 25℃, Zhang et al. (2010)
InChI 1S/C7H3Cl2NO/c8-5-1-6(9)3-7(2-5)10-4-11/h1-3H
InChIKey XEFUJGURFLOFAN-UHFFFAOYSA-N
SMILES Clc1cc(Cl)cc(c1)N=C=O
LogP 3.88
CAS DataBase Reference 34893-92-0(CAS DataBase Reference)
NIST Chemistry Reference 3,5-Dichlorophenyl isocyanate(34893-92-0)
EPA Substance Registry System 3,5-Dichlorophenyl isocyanate (34893-92-0)
UNSPSC Code 12352100
NACRES NA.22

Safety

Symbol(GHS) Skull and Crossbones (GHS06)Health Hazard (GHS08)Environment (GHS09)
Signal wordDanger
Hazard statements H315-H317-H319-H330-H334-H335-H411
Precautionary statements P260-P273-P280-P302+P352-P304+P340+P310-P305+P351+P338
Hazard Codes  T,T+
Risk Statements  23/24/25-36/37/38-42-26
Safety Statements  26-27-36/37/39-45-38-37/39-28A
RIDADR  UN 2250 6.1/PG 2
WGK Germany  3
F  19-21
TSCA  TSCA listed
HazardClass  6.1
PackingGroup  II
HS Code  29291090
Storage Class 6.1A - Combustible acute toxic Cat. 1 and 2
very toxic hazardous materials
Hazard Classifications Acute Tox. 1 Inhalation
Aquatic Chronic 2
Eye Irrit. 2
Resp. Sens. 1
Skin Irrit. 2
Skin Sens. 1A
STOT SE 3
NFPA 704:
1
3 0

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3,5-Dichlorophenyl isocyanate Chemical Properties,Usage,Production

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