76420-72-9

Name Enalaprilat
CAS 76420-72-9
EINECS(EC#) 278-459-3
Molecular Formula C18H24N2O5
MDL Number MFCD08060099
Molecular Weight 348.39
MOL File 76420-72-9.mol

Chemical Properties

Appearance White Crystalline Solid
Melting point  148-151°C
alpha  D -67.0° (0.1M HCl)
Boiling point  601.0±55.0 °C(Predicted)
density  1.286±0.06 g/cm3(Predicted)
storage temp.  2-8°C
solubility  Very slightly soluble or slightly soluble in water, sparingly soluble in methanol, practically insoluble in acetonitrile.
form  neat
pka pKa 2.30 (Uncertain);3.39 (Uncertain)
color  White to off-white
Water Solubility  Soluble in water with heating (~60°C)
Usage Active metabolite of Enalapril. A nonsulfhydryl dipeptide angiotensin converting enzyme (ACE) inhibitor
InChI 1S/C18H24N2O5/c1-12(16(21)20-11-5-8-15(20)18(24)25)19-14(17(22)23)10-9-13-6-3-2-4-7-13/h2-4,6-7,12,14-15,19H,5,8-11H2,1H3,(H,22,23)(H,24,25)/t12-,14-,15-/m0/s1
InChIKey LZFZMUMEGBBDTC-QEJZJMRPSA-N
SMILES O=C(N1CCC[C@H]1C(O)=O)[C@H](C)N[C@H](C(O)=O)CCC2=CC=CC=C2
CAS DataBase Reference 76420-72-9(CAS DataBase Reference)
EPA Substance Registry System L-Proline, N-[(1S)-1-carboxy-3-phenylpropyl]-L-alanyl- (76420-72-9)

Safety Data

Hazard Codes  Xn
Risk Statements 
WGK Germany  2
HS Code  2933990099
Storage Class 11 - Combustible Solids
Hazard Classifications Acute Tox. 4 Oral

Hazard Information

Supplier