132907-72-3

Name Ramosetron hydrochloride
CAS 132907-72-3
Molecular Formula C17H18ClN3O
MDL Number MFCD00894748
Molecular Weight 315.8
MOL File 132907-72-3.mol
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Chemical Properties

Melting point  244-246°C
alpha  D -42.9° (c 1.02 in methanol)
storage temp.  -20°C
solubility  H2O: soluble20mg/mL, clear
form  powder
color  white to beige
Optical Rotation [α]/D -40 to -45°, c = 1 in methanol
Water Solubility  H2O: 20mg/mL, clear
Stability: Hygroscopic
InChI InChI=1/C17H17N3O.ClH/c1-20-9-13(12-4-2-3-5-16(12)20)17(21)11-6-7-14-15(8-11)19-10-18-14;/h2-5,9-11H,6-8H2,1H3,(H,18,19);1H/t11-;/s3
InChIKey XIXYTCLDXQRHJO-RFVHGSKJSA-N
SMILES C([C@@H]1CCC2N=CNC=2C1)(C1=CN(C)C2=CC=CC=C12)=O.Cl |&1:1,r|
CAS DataBase Reference 132907-72-3(CAS DataBase Reference)

Safety Data

Symbol(GHS)  Exclamation Mark (GHS07)
GHS07
Signal word  Warning
Hazard statements  H302
Precautionary statements  P264; P270; P301+P312; P330; P501
Hazard Codes  Xn
Risk Statements 
WGK Germany  3
Toxicity
dog,LD,intravenous,> 30mg/kg (30mg/kg),SENSE ORGANS AND SPECIAL SENSES: CONJUNCTIVE IRRITATION: EYE,Oyo Yakuri. Pharmacometrics. Vol. 47, Pg. 117, 1994.

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