21279-52-7

21279-52-7 structure

21279-52-7 structure

Name: 2-[4-[2-(1,3-benzodioxol-5-yl)ethyl]piperazin-1-yl]pyrimidine,dihydrochloride
Chemical Name: 2-[4-[2-(1,3-benzodioxol-5-yl)ethyl]piperazin-1-yl]pyrimidine,dihydrochloride
CAS Number: 21279-52-7
Molecular Formula: C₁₇H₂₂Cl₂N₄O₂
Molecular Weight: 385.28800
Create Date: 2017-09-18 15:25:17
Modify Date: 2024-01-28 16:52:44

Name	2-[4-[2-(1,3-benzodioxol-5-yl)ethyl]piperazin-1-yl]pyrimidine,dihydrochloride

Boiling Point	487ºC at 760 mmHg
Molecular Formula	C₁₇H₂₂Cl₂N₄O₂
Molecular Weight	385.28800
Flash Point	248.3ºC
Exact Mass	384.11200
PSA	50.72000
LogP	3.17690
Vapour Pressure	1.23E-09mmHg at 25°C

CHEMICAL IDENTIFICATION

RTECS NUMBER :: UV9334000

CHEMICAL NAME :: Pyrimidine, 2-(4-(3,4-(methylenedioxy)phenethyl)-1-piperazinyl)-, dihydrochloride, hydrate

CAS REGISTRY NUMBER :: 21279-52-7

LAST UPDATED :: 198612

DATA ITEMS CITED :: 1

MOLECULAR FORMULA :: C17-H20-N4-O2.2Cl-H.H2-O

MOLECULAR WEIGHT :: 402.34

WISWESSER LINE NOTATION :: T56 BO DO CHJ G2- AT6N DNTJ D- BT6N CNJ &GH 2 &QH

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :: LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :: Intraperitoneal

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 400 mg/kg

TOXIC EFFECTS :: Behavioral - analgesia Biochemical - Metabolism (Intermediary) - effect on inflammation or mediation of inflammation

REFERENCE :: JMCMAR Journal of Medicinal Chemistry. (American Chemical Soc., Distribution Office Dept. 223, POB POB 57136, West End Stn., Washington, DC 20037) V.6- 1963- Volume(issue)/page/year: 11,1151,1968