甲氯喹酮
- 中文名称：
- 甲氯喹酮
- 中文别名：
- 甲氯喹酮;
氯安眠酮 新安眠酮
- 英文名称：
- mecloqualone
- 英文别名：
- 3-(2-chlorophenyl)-2-methylquinazolin-4-one;
3-(2-chloro-phenyl)-2-methyl-3,4-dihydro-quinazolin-4-one;
CHI 8;
3-(o-chlorophenyl)-3,4-dihydro-2-methyl-4-quinazolone;
4(3H)-Quinazolinone,3-(2-chlorophenyl)-2-methyl;
2-methyl-3-(o-chlorophenyl)-4(3H)-quinazolinone;
2-methyl-3-(2-chlorophenyl)quinazolin-4(3H)-one;
Mecloqualonum [INN-Latin];
Nubarene;
MECLOQUALONE;
Meclocualona [INN-Spanish];
B 208-Tropon;
3-(2-chloro-phenyl)-2-methyl-3H-quinazolin-4-one;
Casfen;
Mecloqualon
- CAS No.：
- 340-57-8
- 分 子 式：
-
C15H11ClN2O
- 分 子 量：
- 0
- 精确分子量：
- 270.05600
- PSA：
- 34.89000
- InChI：
- The Key: SFITWQDBYUMAPS-UHFFFAOYSA-N3
- SDS：
- 查看
甲氯喹酮 物化性质
- 密度：
- 1.29 g/cm3
- 沸点：
- 421.7ºC at 760 mmHg
- 闪点：
- 208.9ºC
- 折射率：
- 1.647
甲氯喹酮 毒理性
CHEMICAL IDENTIFICATION
- RTECS NUMBER :
- VA2975000
- CHEMICAL NAME :
- 4(3H)-Quinazolinone, 3-(o-chlorophenyl)-2-methyl-
- CAS REGISTRY NUMBER :
- 340-57-8
- BEILSTEIN REFERENCE NO. :
- 0228324
- LAST UPDATED :
- 199612
- DATA ITEMS CITED :
- 3
- MOLECULAR FORMULA :
- C15-H11-Cl-N2-O
- MOLECULAR WEIGHT :
- 270.73
- WISWESSER LINE NOTATION :
- T66 BVN ENJ CR BG& D1
HEALTH HAZARD DATA
ACUTE TOXICITY DATA
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Unreported
- SPECIES OBSERVED :
- Rodent - rat
- DOSE/DURATION :
- 250 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- 27ZQAG "Psychotropic Drugs and Related Compounds," 2nd ed., Usdin, E., and
D.H. Efron, Washington, DC, 1972 Volume(issue)/page/year: -,258,1972
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Oral
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 470 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- ARZNAD Arzneimittel-Forschung. Drug Research. (Editio Cantor Verlag,
Postfach 1255, W-7960 Aulendorf, Fed. Rep. Ger.) V.1- 1951-
Volume(issue)/page/year: 13,688,1963
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Unreported
- SPECIES OBSERVED :
- Mammal - dog
- DOSE/DURATION :
- 100 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- 27ZQAG "Psychotropic Drugs and Related Compounds," 2nd ed., Usdin, E., and
D.H. Efron, Washington, DC, 1972 Volume(issue)/page/year: -,258,1972
甲氯喹酮 海关数据
中国海关编码：2933550011
- 概述：
- HS:2933550011 甲氯喹酮,甲喹酮〔以及它们的盐〕 增值税率:17.0% 退税率:9.0% 监管条件:I 最低关税: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
- 监管条件：
- I.精神药物进(出)口准许证
- 摘要/Summary：
- HS:2933550011 2-methyl-3-(o-tolyl)quinazolin-4(3h)-one VAT:17.0% Tax rebate rate:9.0% Supervision conditions:i MFN tariff:6.5% General tariff:20.0%
甲氯喹酮 分子结构与计算化学数据
计算化学数据
1.疏水参数计算参考值（XlogP）:无
2.氢键供体数量:0
3.氢键受体数量:2
4.可旋转化学键数量:1
5.互变异构体数量:5
6.拓扑分子极性表面积:32.7
7.重原子数量:19
8.表面电荷:0
9.复杂度:396
10.同位素原子数量:0
11.确定原子立构中心数量:0
12.不确定原子立构中心数量:0
13.确定化学键立构中心数量:0
14.不确定化学键立构中心数量:0
15.共价键单元数量:1