Dayang Chem (Hangzhou) Co., Ltd.
China
Product Name: 1H-Purine-2,6-dione,3,7-dihydro-3,7-dimethyl-1-(2-methyl-2-propen-1-yl)-
Price: $Inquiry/100g $Inquiry/1kg $Inquiry/100kg $Inquiry/1000kg
Purity: 98.0%
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Contact: Ms Wang

63906-62-7

63906-62-7 structure

63906-62-7 structure

Name: 1H-Purine-2,6-dione,3,7-dihydro-3,7-dimethyl-1-(2-methyl-2-propen-1-yl)-
Chemical Name: 3,7-dimethyl-1-(2-methylprop-2-enyl)purine-2,6-dione
CAS Number: 63906-62-7
Molecular Formula: C₁₁H₁₄N₄O₂
Molecular Weight: 234.25400
Create Date: 2017-04-03 02:23:20
Modify Date: 2024-07-18 16:33:38

Name	3,7-dimethyl-1-(2-methylprop-2-enyl)purine-2,6-dione

Density	1.29g/cm3
Boiling Point	437.9ºC at 760 mmHg
Molecular Formula	C₁₁H₁₄N₄O₂
Molecular Weight	234.25400
Flash Point	218.7ºC
Exact Mass	234.11200
PSA	61.82000
LogP	0.00980
Index of Refraction	1.625

CHEMICAL IDENTIFICATION

RTECS NUMBER :: XH2470000

CHEMICAL NAME :: Theobromine, 1-(2'-methylallyl)-

CAS REGISTRY NUMBER :: 63906-62-7

LAST UPDATED :: 199009

DATA ITEMS CITED :: 1

MOLECULAR FORMULA :: C11-H14-N4-O2

MOLECULAR WEIGHT :: 234.29

WISWESSER LINE NOTATION :: T56 BN DN FNVNVJ B1 F1 H1UY1&1

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 :: 254 mg/kg

TOXIC EFFECTS :: Behavioral - convulsions or effect on seizure threshold

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: 86,113,1946