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50-42-0

50-42-0 Structure

50-42-0 Structure
IdentificationMore
[Name]

Adiphenine hydrochloride
[CAS]

50-42-0
[Synonyms]

2-DIETHYLAMINOETHYL DIPHENYLACETATE HYDROCHLORIDE
ADIPHENINE
ADIPHENINE HCL
ADIPHENINE HYDROCHLORIDE
ALPHA-PHENYLBENZENEACETIC ACID 2-[DIETHYLAMINO]ETHYL ESTER HYDROCHLORIDE
DIPHENYLACETIC ACID 2-(DIETHYLAMINO)ETHYL ESTER HYDROCHLORIDE
DIPHENYLACETYLDIETHYLAMINOETHANOL HYDROCHLORIDE
aceticacid,diphenyl-,2-(diethylamino)ethylester,hydrochloride
adifeninhydrochloride
adiphenhydrochloride
benzeneaceticacid,alpha-phenyl-,2-(diethylamino)ethyl-ester,hydrochloride
difacilhydrochloride
diphacilhydrochloride
diphenylacetatedudiethylamino-ethanolchlorhydrate
ethanol,2-(diethylamino)-,2,2-diphenylacetate,hydrochloride
patrovina
paxil(anticolinergic)
sentiv
spasmolytinhydrochloride
trasentinehydrochloride
[EINECS(EC#)]

200-036-9
[Molecular Formula]

C20H25NO2
[MDL Number]

MFCD00242658
[Molecular Weight]

311.42
[MOL File]

50-42-0.mol
Chemical PropertiesBack Directory
[Melting point ]

113-114°
[density ]

1.0555 (rough estimate)
[refractive index ]

1.5400 (estimate)
[storage temp. ]

Room Temperature
[solubility ]

DMSO (Slightly), Methanol (Slightly), Water (Very Slightly)
[form ]

neat
[color ]

White
[Merck ]

14,161
[InChI]

InChI=1S/C20H25NO2.ClH/c1-3-21(4-2)15-16-23-20(22)19(17-11-7-5-8-12-17)18-13-9-6-10-14-18;/h5-14,19H,3-4,15-16H2,1-2H3;1H
[InChIKey]

LKPINBXAWIMZCG-UHFFFAOYSA-N
[SMILES]

C(C(=O)OCCN(CC)CC)(C1=CC=CC=C1)C1=CC=CC=C1.Cl
[CAS DataBase Reference]

50-42-0(CAS DataBase Reference)
Safety DataBack Directory
[Hazard Codes ]

Xn
[Risk Statements ]

R20/21/22:Harmful by inhalation, in contact with skin and if swallowed .
[Safety Statements ]

S36:Wear suitable protective clothing .
[WGK Germany ]

3
[RTECS ]

AH2625000
[HS Code ]

2922.19.7000
[Toxicity]

LD50 i.p. in mice: 0.24 g/kg (Burtner, Cusic)
Material Safety Data Sheet(MSDS)Back Directory
[msds information]

Diphenylacetic acid 2-(diethylamino)ethyl ester hydrochloride(50-42-0).msds
Hazard InformationBack Directory
[Originator]

Adiphenine hydrochloride,Spectrum Chemicals and Laboratory Products, Inc.
[Uses]

Adiphenine hydrochloride is an anticholinergic. Adiphenine hydrochloride is used as an antispasmodic.
[Uses]

radioprotectant
[Manufacturing Process]

10.6 parts of α,α-diphenylacetic acid are treated with thionyl chloride and the diphenylacetylchloride thus produced is caused to react with 5.9 parts of diethylaminoethanol at 120°C. The α,α-diphenylacetic acid, 2- (diethylamino)ethanol ester hydrochloride thus produced is crystallized from ethyl acetate; it melts at 113-114°C.
[Therapeutic Function]

Anticholinergic, Spasmolytic, Smooth muscle relaxant
[in vivo]

Adiphenine (i.p.) prevents the hindleg tonic-extensor component of maximal electroshock seizures (MES), with an ED50 of 62 mg/kg in mice[3].

Spectrum DetailBack Directory
[Spectrum Detail]

Adiphenine hydrochloride(50-42-0)1HNMR
Well-known Reagent Company Product InformationBack Directory
[Sigma Aldrich]

50-42-0(sigmaaldrich)
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