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Dayang Chem (Hangzhou) Co., Ltd.
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Product Name: 1,3-dimethyl-7-prop-2-enyl-purine-2,6-dione
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61444-26-6

61444-26-6 structure

61444-26-6 structure

Name: 1,3-dimethyl-7-prop-2-enyl-purine-2,6-dione
Chemical Name: 1,3-dimethyl-7-prop-2-enylpurine-2,6-dione
CAS Number: 61444-26-6
Molecular Formula: C₁₀H₁₂N₄O₂
Molecular Weight: 220.22800
Create Date: 2017-03-14 23:39:19
Modify Date: 2024-04-02 13:43:53

Name	1,3-dimethyl-7-prop-2-enylpurine-2,6-dione
Synonyms	Theophylline,7-allyl N-allyltheophyllin N7-Allyltheophylline N5-allyl-1,3-dimethylxanthine N-allyltheophylline 7-Allyltheophylline 7-Allyl-1,3-dimethyl-3,7-dihydro-purine-2,6-dione 1H-Purine-2,6-dione,3,7-dihydro-1,3-dimethyl-7-(2-propenyl) 7-allyl-1,3-dimethylxanthine

Density	1.32g/cm3
Boiling Point	426.1ºC at 760 mmHg
Molecular Formula	C₁₀H₁₂N₄O₂
Molecular Weight	220.22800
Flash Point	211.5ºC
Exact Mass	220.09600
PSA	61.82000
Index of Refraction	1.638

CHEMICAL IDENTIFICATION

RTECS NUMBER :: XH3859550

CHEMICAL NAME :: Theophylline, 7-allyl-

CAS REGISTRY NUMBER :: 61444-26-6

BEILSTEIN REFERENCE NO. :: 0226015

LAST UPDATED :: 199612

DATA ITEMS CITED :: 2

MOLECULAR FORMULA :: C10-H12-N4-O2

MOLECULAR WEIGHT :: 220.26

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

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

ROUTE OF EXPOSURE :: Oral

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 315 mg/kg

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

REFERENCE :: JPETAB Journal of Pharmacology and Experimental Therapeutics. (Williams & Wilkins Co., 428 E. Preston St., Baltimore, MD 21202) V.1- 1909/10- Volume(issue)/page/year: 116,343,1956

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

ROUTE OF EXPOSURE :: Intraperitoneal

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 299 mg/kg

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

REFERENCE :: JPETAB Journal of Pharmacology and Experimental Therapeutics. (Williams & Wilkins Co., 428 E. Preston St., Baltimore, MD 21202) V.1- 1909/10- Volume(issue)/page/year: 116,343,1956

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