1-Propyl theobromine

1-Propyl theobromine名称

[ CAS 号 ]:
63906-63-8

[ 英文名 ]:
1-Propyl theobromine

[英文别名 ]:

Theobromine,n-propyl derivative
1-n-Propyl-3,7-dimethylxanthine
1-Propyl theobromine
Theobromine,1-propyl

1-Propyl theobromine物理化学性质

[ 密度 ]:
1.34g/cm3

[ 沸点 ]:
427ºC at 760mmHg

[ 分子式 ]:
C₁₀H₁₄N₄O₂

[ 分子量 ]:
222.24400

[ 闪点 ]:
212ºC

[ 精确质量 ]:
222.11200

[ PSA ]:
61.82000

[ 折射率 ]:
1.638

1-Propyl theobromine毒性和生态

CHEMICAL IDENTIFICATION

RTECS NUMBER :: XH2480000

CHEMICAL NAME :: Theobromine, 1-propyl-

CAS REGISTRY NUMBER :: 63906-63-8

BEILSTEIN REFERENCE NO. :: 0023217

LAST UPDATED :: 199612

DATA ITEMS CITED :: 4

MOLECULAR FORMULA :: C10-H14-N4-O2

MOLECULAR WEIGHT :: 222.28

WISWESSER LINE NOTATION :: T56 BN DN FNVNVJ B1 F1 H3

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :: TDLo - Lowest published toxic dose

ROUTE OF EXPOSURE :: Oral

SPECIES OBSERVED :: Human

DOSE/DURATION :: 26 mg/kg

TOXIC EFFECTS :: Behavioral - changes in motor activity (specific assay) Gastrointestinal - nausea or vomiting Skin and Appendages - sweating

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

ROUTE OF EXPOSURE :: Intravenous

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 126 mg/kg

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

MUTATION DATA

TYPE OF TEST :: DNA inhibition

TEST SYSTEM :: Human Cells - not otherwise specified

DOSE/DURATION :: 4 mmol/L

REFERENCE :: BIOJAU Biophysical Journal. (Rockefeller Univ. Press, 1230 York Ave., New York, NY 10021) V.1- 1960- Volume(issue)/page/year: 35,665,1981

1-Propyl theobromine安全信息

[ 海关编码 ]:
2933990090

1-Propyl theobromine合成路线

详细合成路线

1-Propyl theobromine上下游产品

1-Propyl theobromine上游产品

1-Propyl theobromine下游产品

1-Propyl theobromine海关

[ 海关编码 ]: 2933990090

[ 中文概述 ]:
2933990090. 其他仅含氮杂原子的杂环化合物. 增值税率:17.0%. 退税率:13.0%. 监管条件:无. 最惠国关税:6.5%. 普通关税:20.0%

[ 申报要素 ]: 品名, 成分含量, 用途, 乌洛托品请注明外观, 6－己内酰胺请注明外观, 签约日期

[ 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%