CAS Registry Number®
125494-59-9
CAS Name
Sibutramine hydrochloride monohydrate
Molecular Formula
C17H26ClN.ClH.H2O
Compound Properties
-
Melting Point (1)
193-195.5 °C
Source(s)
- (1) Hazardous Substances Data Bank data were obtained from the National Library of Medicine (US)
Other Names and Identifiers
InChI
InChI=1S/C17H26ClN.ClH.H2O/c1-13(2)12-16(19(3)4)17(10-5-11-17)14-6-8-15(18)9-7-14;;/h6-9,13,16H,5,10-12H2,1-4H3;1H;1H2
InChIKey
InChIKey=KFNNPQDSPLWLCX-UHFFFAOYSA-N
SMILES
C(CC(C)C)(N(C)C)C1(CCC1)C2=CC=C(Cl)C=C2.Cl.O
Canonical SMILES
Cl.ClC1=CC=C(C=C1)C2(CCC2)C(N(C)C)CC(C)C.O
Other Names for this Substance
- Cyclobutanemethanamine, 1-(4-chlorophenyl)-N,N-dimethyl-α-(2-methylpropyl)-, hydrochloride, hydrate (1:1:1)
- Cyclobutanemethanamine, 1-(4-chlorophenyl)-N,N-dimethyl-α-(2-methylpropyl)-, hydrochloride, monohydrate
- Sibutramine hydrochloride monohydrate
- 1-(1-(4-Chlorophenyl)cyclobutyl)-N,N,3-trimethylbutan-1-amine hydrochloride hydrate
