替培啶

替培啶 基本信息
CAS号 5169-78-8 分子式 C15H17NS2
分子量 275.43200 精确质量  275.08000
PSA  59.72000 LogP  4.27500

基本信息 展开↓

CAS号:
5169-78-8
3D弹球模型:
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分子式:
C15H17NS2
分子量:
275.43200
中文名称:
替培啶
英文名称:
3-(dithiophen-2-ylmethylidene)-1-methylpiperidine
中文别名:
替培啶
英文别名:
3-(dithiophen-2-ylmethylidene)-1-methylpiperidine;
3-(di-thiophen-2-yl-methylene)-1-methyl-piperidine;
Bitiodin;
Asverin;
(1-Methyl-3-piperidylidene)di(2-thienyl)methane;
Tipepidine [INN:DCF];
Tipepidine;
3-(Di-[2]thienyl-methylen)-1-methyl-piperidin;
Tipepidina [INN-Spanish];
Tipedine;
Tipepidinum [INN-Latin];
(1-Methyl-3-piperidyliden)di-2-thienylmethan-embonat;
CR/662;
AT 327;
3-(di-[2]thienyl-methylene)-1-methyl-piperidine
精确分子量/精确质量:
275.08000
极性分子表面积/PSA:
59.72000
油水分配系数/LogP:

LogP值指的是某物质在正辛醇/水两相体系中的分配系数的对数值,反映了物质在油水两相中的分配情况。其中、LogP值越大,说明该物质越亲油;反之,LogP值越小,则说明该物质越亲水。
InChI:
The Key: JWIXXNLOKOAAQT-UHFFFAOYSA-N

安全信息展开↓

海关代码:
2934999090

合成路线查看所有的合成路线

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    (1-methyl-piperidin-3-yl)-di-thiophen-2-yl-methanol

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    替培啶

毒理性展开↓

CHEMICAL IDENTIFICATION

RTECS NUMBER :
TM7870000
CHEMICAL NAME :
Piperidine, 3-(di-2-thienylmethylene)-1-methyl-
CAS REGISTRY NUMBER :
5169-78-8
BEILSTEIN REFERENCE NO. :
0212554
LAST UPDATED :
199612
DATA ITEMS CITED :
6
MOLECULAR FORMULA :
C15-H17-N-S2
MOLECULAR WEIGHT :
275.45
WISWESSER LINE NOTATION :
T6N CYTJ A1 CUY- BT5SJ&- BT5SJ

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 :
867 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
85KYAH "Merck Index; an Encyclopedia of Chemicals, Drugs, and Biologicals", 11th ed., Rahway, NJ 07065, Merck & Co., Inc. 1989 Volume(issue)/page/year: 11,1490,1989
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
294 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
85KYAH "Merck Index; an Encyclopedia of Chemicals, Drugs, and Biologicals", 11th ed., Rahway, NJ 07065, Merck & Co., Inc. 1989 Volume(issue)/page/year: 11,1490,1989
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Subcutaneous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
222 mg/kg
TOXIC EFFECTS :
Brain and Coverings - recordings from specific areas of CNS Behavioral - excitement Lungs, Thorax, or Respiration - other changes
REFERENCE :
CPBTAL Chemical and Pharmaceutical Bulletin. (Japan Pub. Trading Co., USA, 1255 Howard St., San Francisco, CA 94103) V.6- 1958- Volume(issue)/page/year: 7,372,1959
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
55 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
PCJOAU Pharmaceutical Chemistry Journal (English Translation). Translation of KHFZAN. (Plenum Pub. Corp., 233 Spring St., New York, NY 10013) No.1- 1967- Volume(issue)/page/year: 10,1482,1976
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intramuscular
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
308 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
85KYAH "Merck Index; an Encyclopedia of Chemicals, Drugs, and Biologicals", 11th ed., Rahway, NJ 07065, Merck & Co., Inc. 1989 Volume(issue)/page/year: 11,1490,1989
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Mammal - dog
DOSE/DURATION :
44 mg/kg
TOXIC EFFECTS :
Behavioral - food intake (animal) Behavioral - muscle weakness Lungs, Thorax, or Respiration - respiratory stimulation
REFERENCE :
CPBTAL Chemical and Pharmaceutical Bulletin. (Japan Pub. Trading Co., USA, 1255 Howard St., San Francisco, CA 94103) V.6- 1958- Volume(issue)/page/year: 7,372,1959

海关数据查看详细

中国海关编码:2934999090

概述:
2934999090. 其他杂环化合物. 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
摘要/Summary:
2934999090. other heterocyclic compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

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