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Product Name: 8-Cyclopentylmethyl-3,7-dihydro-1,3,7-trimethyl-1H-purine-2,6-dione
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73747-32-7

73747-32-7 structure

73747-32-7 structure

Name: 8-Cyclopentylmethyl-3,7-dihydro-1,3,7-trimethyl-1H-purine-2,6-dione
Chemical Name: 8-(cyclopentylmethyl)-1,3,7-trimethylpurine-2,6-dione
CAS Number: 73747-32-7
Molecular Formula: C₁₄H₂₀N₄O₂
Molecular Weight: 276.33400
Create Date: 2017-03-09 14:50:26
Modify Date: 2024-09-20 17:11:21

Name	8-(cyclopentylmethyl)-1,3,7-trimethylpurine-2,6-dione
Synonyms	CAFFEINE,8-(CYCLOPENTYLMETHYL) 8-(Cyclopentylmethyl)caffeine

Density	1.37g/cm3
Boiling Point	474.6ºC at 760 mmHg
Molecular Formula	C₁₄H₂₀N₄O₂
Molecular Weight	276.33400
Flash Point	240.9ºC
Exact Mass	276.15900
PSA	61.82000
LogP	0.70340
Index of Refraction	1.672

CHEMICAL IDENTIFICATION

RTECS NUMBER :: EV6497000

CHEMICAL NAME :: Caffeine, 8-(cyclopentylmethyl)-

CAS REGISTRY NUMBER :: 73747-32-7

LAST UPDATED :: 197903

DATA ITEMS CITED :: 1

MOLECULAR FORMULA :: C14-H20-N4-O2

MOLECULAR WEIGHT :: 276.38

WISWESSER LINE NOTATION :: T56 BN DN FNVNVJ B1 F1 H1 C1- AL5TJ

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 :: 56 mg/kg

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

REFERENCE :: CSLNX* U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. (Aberdeen Proving Ground, MD 21010) Volume(issue)/page/year: NX#06866

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