5096-26-4

5096-26-4 structure

5096-26-4 structure

Name: 7-[3-(dipropylamino)-2-hydroxypropyl]-1,3-dimethylpurine-2,6-dione
Chemical Name: 7-[3-(dipropylamino)-2-hydroxypropyl]-1,3-dimethylpurine-2,6-dione
CAS Number: 5096-26-4
Molecular Formula: C₁₆H₂₇N₅O₃
Molecular Weight: 337.41700
Create Date: 2018-06-11 11:51:53
Modify Date: 2023-01-16 21:00:14

Name	7-[3-(dipropylamino)-2-hydroxypropyl]-1,3-dimethylpurine-2,6-dione
Synonyms	7-<2-Hydroxy-3-dipropylamino-propyl>-theophyllin

Density	1.25g/cm3
Boiling Point	549.7ºC at 760 mmHg
Molecular Formula	C₁₆H₂₇N₅O₃
Molecular Weight	337.41700
Flash Point	286.3ºC
Exact Mass	337.21100
PSA	85.29000
Index of Refraction	1.597

CHEMICAL IDENTIFICATION

RTECS NUMBER :: XH5137000

CHEMICAL NAME :: Theophylline, 7-(3-(dipropylamino)-2-hydroxypropyl)-

CAS REGISTRY NUMBER :: 5096-26-4

BEILSTEIN REFERENCE NO. :: 1227149

LAST UPDATED :: 199612

DATA ITEMS CITED :: 1

MOLECULAR FORMULA :: C16-H27-N5-O3

MOLECULAR WEIGHT :: 337.48

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 :: 350 mg/kg

TOXIC EFFECTS :: Peripheral Nerve and Sensation - spastic paralysis with or without sensory change Sense Organs and Special Senses (Eye) - effect, not otherwise specified Behavioral - convulsions or effect on seizure threshold

REFERENCE :: DIPHAH Dissertationes Pharmaceuticae. (Warsaw, Poland) V.1-17, 1949-65. For publisher information, see PJPPAA. Volume(issue)/page/year: 17,475,1965

HS Code	2933990090

HS Code	2933990090
Summary	2933990090. heterocyclic compounds with nitrogen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%