51940-44-4

Name Pipemidic acid
CAS 51940-44-4
EINECS(EC#) 257-530-2
Molecular Formula C6H11NO2
MDL Number MFCD00057291
Molecular Weight 129.16
MOL File 51940-44-4.mol

Chemical Properties

Melting point  251-255℃
Boiling point  717℃
density  1.1931 (rough estimate)
refractive index  1.7000 (estimate)
Fp  >110°(230°F)
storage temp.  Amber Vial, -20°C Freezer, Under inert atmosphere
solubility  1 M NaOH: soluble50mg/mL
form  Powder
pka 4.14±0.20(Predicted)
color  White to off-white
Water Solubility  Soluble in 1N sodium hydroxide or in DMSO. Insoluble in water
Sensitive  Light Sensitive
InChI InChI=1S/C14H17N5O3/c1-2-18-8-10(13(21)22)11(20)9-7-16-14(17-12(9)18)19-5-3-15-4-6-19/h7-8,15H,2-6H2,1H3,(H,21,22)
InChIKey JOHZPMXAZQZXHR-UHFFFAOYSA-N
SMILES C1(N2CCNCC2)=NC=C2C(=O)C(C(O)=O)=CN(CC)C2=N1
CAS DataBase Reference 51940-44-4(CAS DataBase Reference)

Safety Data

Symbol(GHS)  Health Hazard (GHS08)
GHS08
Signal word  Danger
Hazard statements  H317-H334
Precautionary statements  P280-P302+P352
Hazard Codes  Xi
Risk Statements 
Safety Statements 
WGK Germany  2
RTECS  UV1153800
HS Code  29335990
Storage Class 11 - Combustible Solids
Hazard Classifications Resp. Sens. 1
Skin Sens. 1
Toxicity
LD50 in mice (mg/kg): 4000 orally; 1000 i.p., 50 i.v. (Ficicchia)

Hazard Information

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