Clopidol Structure

Clopidol

Chemical Properties

Melting point >320℃
Boiling point 318.4±37.0 °C(Predicted)
Density  1.2494 (rough estimate)
refractive index  1.5500 (estimate)
storage temp.  Inert atmosphere,Room Temperature
solubility  Aqueous Base (Slightly), Methanol (Slightly, Heated)
form  Solid
pka 5.50±0.33(Predicted)
color  White to Off-White
Water Solubility  40mg/L(temperature not stated)
Henry's Law Constant 9.9×103 mol/(m3Pa) at 25℃, HSDB (2015)
Stability Hygroscopic
Major Application forensics and toxicology
pharmaceutical (small molecule)
InChI 1S/C7H7Cl2NO/c1-3-5(8)7(11)6(9)4(2)10-3/h1-2H3,(H,10,11)
InChIKey QCMHHYSPKNVXLR-UHFFFAOYSA-N
SMILES Cc1nc(C)c(Cl)c(O)c1Cl
CAS DataBase Reference 2971-90-6(CAS DataBase Reference)
FDA 21 CFR 556.160; 558.175; 558.4
EWG's Food Scores 1
FDA UNII 8J763HFF5N
EPA Substance Registry System Clopidol (2971-90-6)
UNSPSC Code 41116107
NACRES NA.24

Safety

Symbol(GHS) Exclamation Mark (GHS07)
Signal wordWarning
Hazard statements H315-H319-H335
Precautionary statements P261-P264-P271-P280-P302+P352-P305+P351+P338
Hazard Codes  Xi
Risk Statements  36/37/38
Safety Statements  26
OEB B
OEL TWA: 10 mg/m3 (total), STEL: 20 mg/m3 (total)
WGK Germany  2
RTECS  UU7711500
HS Code  29333990
Storage Class 11 - Combustible Solids
Hazard Classifications Eye Irrit. 2
Skin Irrit. 2
STOT SE 3
Hazardous Substances Data 2971-90-6(Hazardous Substances Data)
Toxicity LD50 orally in rats: 18 g/kg (Plisek)
NFPA 704:
0
2 0

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