8-Cyclopentylmethyl-3,7-dihydro-1,3,7-trimethyl-1H-purine-2,6-dione

名称

[ CAS 号 ]:
73747-32-7

[ 英文名 ]:
8-Cyclopentylmethyl-3,7-dihydro-1,3,7-trimethyl-1H-purine-2,6-dione

[英文别名 ]:

CAFFEINE,8-(CYCLOPENTYLMETHYL)
8-(Cyclopentylmethyl)caffeine

物理化学性质

[ 密度 ]:
1.37g/cm3

[ 沸点 ]:
474.6ºC at 760 mmHg

[ 分子式 ]:
C₁₄H₂₀N₄O₂

[ 分子量 ]:
276.33400

[ 闪点 ]:
240.9ºC

[ 精确质量 ]:
276.15900

[ PSA ]:
61.82000

[ LogP ]:
0.70340

[ 折射率 ]:
1.672

毒性和生态

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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