CAS No. 116666-63-8

 

Product Information

Chemical Formula: C29H40Cl2FN3O3
Molecular Weight:568.55
Synonyms:(1S-Cis)-Orid; 2-(2-((3-(1H-Benzimidazol-2-Yl)Propyl)Methylamino)Ethyl)-Aceticaci; 6-Fluoro-1,2,3,4-Tetrahydro-1-(1-Methylethyl)-2-Naphthalenylester,Dihydrochl; Ro40-5967/001; Mibefradil Dihcl; Mibefradil Hydrate Dihydrochloride; Ro 40-5967 Hydrate, (1S,2S)-2-[2[[3-(2-Benzimidazolylpropyl]Methylamino]Ethyl]-6-Fluoro-1,2,3,4-Tetrahydro-1-Isopropyl-2-Naphthyl Methoxyacetate Hydrate Dihydrochloride; Acetic Acid, Methoxy-, 2-(2-((3-(1H-Benzimidazol-2-Yl)Propyl)Methylamino)Ethyl)-6-Fluoro-1,2,3,4-Tetrahydro-1-(1-Methylethyl)-2-Naphthalenyl Ester, Dihydrochloride, (1S-Cis)-
MDL No.:MFCD00881804
EINECS / EC No.:N/A
Pubchem CID:60662
IUPAC Name:[(1S,2S)-2-[2-[3-(1H-benzimidazol-2-yl)propyl-methylamino]ethyl]-6-fluoro-1-propan-2-yl-3,4-dihydro-1H-naphthalen-2-yl] 2-methoxyacetate;dihydrochloride
Standard InchI:InChI=1S/C29H38FN3O3.2ClH/c1-20(2)28-23-12-11-22(30)18-21(23)13-14-29(28,36-27(34)19-35-4)15-17-33(3)16-7-10-26-31-24-8-5-6-9-25(24)32-26;;/h5-6,8-9,11-12,18,20,28H,7,10,13-17,19H2,1-4H3,(H,31,32);2*1H/t28-,29-;;/m0../s1
InchI Key:MTJLQTFHJIHXIX-GDUXWEAWSA-N
SMILES:CC(C)C1C2=C(CCC1(CCN(C)CCCC3=NC4=CC=CC=C4N3)OC(=O)COC)C=C(C=C2)F.Cl.Cl
Appearance:white solid
Melting Point:107-109
Boiling Point:647.6 °Cat760mmHg
Density (Theoretical): g/cm3
Solubility:H2O: 24 mg/mL, soluble

Safety Information

Signal Word: Warning
Hazard Statements:H302
Precautionary Statements:P280-P305 P351 P338
Flash Point:345.5 °C
Transportation Information:N/A
GHS Pictograms:Exclamation Mark - GHS07