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Structure

4-[4-[3-(Trifluoromethyl)phenyl]piperazin-1-ium-1-yl]-1-(3,4,5-trimethoxyphenyl)butan-1-one chloride

CAS
23771-12-2
Catalog Number
ACM23771122
Category
Other Products
Molecular Weight
502.954 g/mol
Molecular Formula
C24H30ClF3N2O4

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Specification

Synonyms
CID32074, LS-48483, BUTYROPHENONE, 3,4,5-TRIMETHOXY-4-(4-(alpha,alpha,alpha-TRIFLUORO-m-TOLYL)-1-, 23771-12-2, Butyrophenone, 3,4,5-trimethoxy-4-(4-(alpha,alpha,alpha-trifluoro-m-tolyl)-1-piperazinyl)-, monohydrochloride
IUPAC Name
4-[4-[3-(trifluoromethyl)phenyl]piperazin-1-ium-1-yl]-1-(3,4,5-trimethoxyphenyl)butan-1-one chloride
Canonical SMILES
COC1=CC(=CC(=C1OC)OC)C(=O)CCC[NH+]2CCN(CC2)C3=CC=CC(=C3)C(F)(F)F.[Cl-]
InChI Key
FUIIBZZLIMCDIH-UHFFFAOYSA-N
Boiling Point
566.9ºC at 760 mmHg
Flash Point
296.7ºC
Exact Mass
502.18500
H-Bond Acceptor
9
H-Bond Donor
1
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