78415-72-2

Name Milrinone
CAS 78415-72-2
EINECS(EC#) 278-903-6
Molecular Formula C12H9N3O
MDL Number MFCD00133539
Molecular Weight 211.22
MOL File 78415-72-2.mol

Chemical Properties

Appearance Crystalline Solid
Melting point  >3000C
Boiling point  350.9°C (rough estimate)
density  1.1922 (rough estimate)
refractive index  1.5700 (estimate)
storage temp.  2-8°C
solubility  DMSO: >10 mg/mL
form  powder
pka 7.21±0.10(Predicted)
color  off-white
Stability: Stable. Incompatible with strong oxidizing agents.
Water Solubility  Soluble in DMSO. Insoluble in water.
Usage Selective phosphodiesterase inhibitor with vasodilating and positive inotropic activity. Cardiotonic
Merck  6197
InChI InChI=1S/C12H9N3O/c1-8-11(9-2-4-14-5-3-9)6-10(7-13)12(16)15-8/h2-6H,1H3,(H,15,16)
InChIKey FYEJSUDMDUIMKJ-UHFFFAOYSA-N
SMILES C1(C)NC(=O)C(C#N)=CC=1C1C=CN=CC=1
CAS DataBase Reference 78415-72-2(CAS DataBase Reference)

Safety Data

Hazard Codes  T,T+
Risk Statements 
R23/24/25:Toxic by inhalation, in contact with skin and if swallowed .
R26/27/28:Very Toxic by inhalation, in contact with skin and if swallowed .
Safety Statements 
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection .
S45:In case of accident or if you feel unwell, seek medical advice immediately (show label where possible) .
S22:Do not breathe dust .
RIDADR  UN 2811 6.1/PG 3
WGK Germany  3
RTECS  DW1762000
HazardClass  6.1(b)
PackingGroup  III
HS Code  38220090
Storage Class 6.1C - Combustible acute toxic Cat.3
toxic compounds or compounds which causing chronic effects
Hazard Classifications Acute Tox. 3 Oral

Hazard Information

Material Safety Data Sheet(MSDS)

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Spectrum Detail

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