102071-21-6

102071-21-6 structure

102071-21-6 structure

Name: 8-Bromo-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione-4-(dipheny lmethoxy)-1-methylpiperidine (1:1)
Chemical Name: 8-Bromo-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione-4-(dipheny lmethoxy)-1-methylpiperidine (1:1)
CAS Number: 102071-21-6
Molecular Formula: C₂₆H₃₀BrN₅O₃
Molecular Weight: 540.45200
Create Date: 2016-10-19 11:21:54
Modify Date: 2024-01-02 18:38:12

Name	8-Bromo-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione-4-(dipheny lmethoxy)-1-methylpiperidine (1:1)

Boiling Point	378.7ºC at 760 mmHg
Molecular Formula	C₂₆H₃₀BrN₅O₃
Molecular Weight	540.45200
Flash Point	111.6ºC
Exact Mass	539.15300
PSA	85.15000
LogP	3.54750
Vapour Pressure	6.18E-06mmHg at 25°C

CHEMICAL IDENTIFICATION

RTECS NUMBER :: TM7822000

CHEMICAL NAME :: Piperidine, 4-(diphenylmethoxy)-1-methyl-, bromotheophylline

CAS REGISTRY NUMBER :: 102071-21-6

LAST UPDATED :: 198609

DATA ITEMS CITED :: 1

MOLECULAR FORMULA :: C19-H23-N-O.C7-H7-Br-N4-O2

MOLECULAR WEIGHT :: 540.52

WISWESSER LINE NOTATION :: T56 BM DN FNVNVJ E1 G1 XE &T6NTJ A1 DOYR&R

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

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

ROUTE OF EXPOSURE :: Intravenous

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 72 mg/kg

TOXIC EFFECTS :: Details of toxic effects not reported other than lethal dose value

REFERENCE :: ARZNAD Arzneimittel-Forschung. Drug Research. (Editio Cantor Verlag, Postfach 1255, W-7960 Aulendorf, Fed. Rep. Ger.) V.1- 1951- Volume(issue)/page/year: 5,185,1955