9,10-Ethanoanthracene-9(10H)-propanamine,N-methyl-
- 中文别名:马普替林; 马洛噻平; N-甲基-9,10-桥亚乙基蒽-9(10H)-丙胺
- 中文释义:马普替林;N-甲基-9,10-桥亚乙基蒽-9(10H)-丙胺;吗丙啶
- 英文别名:maprotiline;
[14C]-Maprotiline;
Maprotilinum [INN-Latin];
Maprotilinum;
Deprilept;
Maprotilin;
Maprotilina;
3-(9,10-Dihydro-9,10-ethanoanthracen-9-yl)-N-methylpropan-1-amine;
9-[3-(methylamino)propyl]-9,10-dihydro-9,10-ethanoanthracene;
Dibencycladine;
Maprotilina [INN-Spanish];
Maprotylina [Polish];
N-methyl-9,10-ethanoanthracene-9(10H)-propanamine;
Maprotylina
- CAS No.:10262-69-8
- 分子式:C20H23N
- 分子量:277.41
- 精确分子量:277.18300
- PSA:12.03000
- InChI:The Key: QSLMDECMDJKHMQ-UHFFFAOYSA-N
- 分子结构式:
物化性质
- 密度:
- 1.08 g/cm3
- 沸点:
- 399.6ºC at 760 mmHg
- 闪点:
- 187.7ºC
- 折射率:
- 1.599
- 蒸汽压:
- 1.35E-06mmHg at 25°C
- 存储条件/存储方法:
密封于阴凉干燥处。
- 稳定性相关:
遵照规格使用和储存则不会分解。
- 其它信息:
1. 性状:白色结晶性粉末
2. 密度(g/mL,25/4℃): 无可用
3. 相对蒸汽密度(g/mL,空气=1):无可用 4. 熔点(ºC):92-94
5. 沸点(ºC,常压):230-232
6. 沸点(ºC,5.2kPa): 无可用
7. 折射率: 无可用
8. 闪点(ºC): 无可用
9. 比旋光度(º): 无可用
10. 自燃点或引燃温度(ºC): 无可用
11. 蒸气压(kPa,25ºC): 无可用
12. 饱和蒸气压(kPa,60ºC): 无可用
13. 燃烧热(KJ/mol):无可用
14. 临界温度(ºC): 无可用
15. 临界压力(KPa): 无可用
16. 油水(辛醇/水)分配系数的对数值: 无可用
17. 爆炸上限(%,V/V):无可用
18. 爆炸下限(%,V/V): 无可用
19. 溶解性:易溶于氯仿,稍溶于甲醇、乙醇、冰醋酸,难溶于水、仲丁醇,几乎不溶于乙酸乙酯、石油醚。
安全信息
- 密度:
- 1.08 g/cm3
- 沸点:
- 399.6ºC at 760 mmHg
- 闪点:
- 187.7ºC
- 折射率:
- 1.599
- 蒸汽压:
- 1.35E-06mmHg at 25°C
- 存储条件/存储方法:
密封于阴凉干燥处。
- 稳定性相关:
遵照规格使用和储存则不会分解。
- 其它信息:
1. 性状:白色结晶性粉末
2. 密度(g/mL,25/4℃): 无可用
3. 相对蒸汽密度(g/mL,空气=1):无可用 4. 熔点(ºC):92-94
5. 沸点(ºC,常压):230-232
6. 沸点(ºC,5.2kPa): 无可用
7. 折射率: 无可用
8. 闪点(ºC): 无可用
9. 比旋光度(º): 无可用
10. 自燃点或引燃温度(ºC): 无可用
11. 蒸气压(kPa,25ºC): 无可用
12. 饱和蒸气压(kPa,60ºC): 无可用
13. 燃烧热(KJ/mol):无可用
14. 临界温度(ºC): 无可用
15. 临界压力(KPa): 无可用
16. 油水(辛醇/水)分配系数的对数值: 无可用
17. 爆炸上限(%,V/V):无可用
18. 爆炸下限(%,V/V): 无可用
19. 溶解性:易溶于氯仿,稍溶于甲醇、乙醇、冰醋酸,难溶于水、仲丁醇,几乎不溶于乙酸乙酯、石油醚。
毒理性
CHEMICAL IDENTIFICATION
- RTECS NUMBER :
- KJ4552000
- CHEMICAL NAME :
- 9,10-Ethanoanthracene-9(10H)-propylamine, N-methyl-
- CAS REGISTRY NUMBER :
- 10262-69-8
- LAST UPDATED :
- 199612
- DATA ITEMS CITED :
- 9
- MOLECULAR FORMULA :
- C20-H23-N
- MOLECULAR WEIGHT :
- 277.44
- WISWESSER LINE NOTATION :
- L6 H666/GP 2AF P&&TTJ O3M1
HEALTH HAZARD DATA
ACUTE TOXICITY DATA
- TYPE OF TEST :
- TDLo - Lowest published toxic dose
- ROUTE OF EXPOSURE :
- Oral
- SPECIES OBSERVED :
- Human - child
- DOSE/DURATION :
- 26 mg/kg
- TOXIC EFFECTS :
- Behavioral - somnolence (general depressed activity) Behavioral - coma Vascular - BP elevation not characterized in autonomic section
- REFERENCE :
- BMJOAE British Medical Journal. (British Medical Assoc., BMA House, Tavistock Sq., London WC1H 9JR, UK) V.1- 1857- Volume(issue)/page/year: 2,260,1977
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Oral
- SPECIES OBSERVED :
- Rodent - rat
- DOSE/DURATION :
- 760 mg/kg
- TOXIC EFFECTS :
- Behavioral - muscle weakness Behavioral - ataxia Behavioral - muscle contraction or spasticity
- REFERENCE :
- HEPHD2 Handbook of Experimental Pharmacology. (Springer-Verlag, Heidelberger Pl. 3, D-1000 Berlin 33, Fed. Rep. Ger.) V.50- 1978- Volume(issue)/page/year: 55,527,1980
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Intraperitoneal
- SPECIES OBSERVED :
- Rodent - rat
- DOSE/DURATION :
- 105 mg/kg
- TOXIC EFFECTS :
- Behavioral - somnolence (general depressed activity) Behavioral - muscle weakness Lungs, Thorax, or Respiration - dyspnea
- REFERENCE :
- APPHAX Acta Poloniae Pharmaceutica. For English translation, see APPFAR. (Ars Polona, POB 1001, 00-680 Warsaw 1, Poland) V.1- 1937- Volume(issue)/page/year: 40,235,1983
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Intravenous
- SPECIES OBSERVED :
- Rodent - rat
- DOSE/DURATION :
- 38 mg/kg
- TOXIC EFFECTS :
- Behavioral - muscle weakness Behavioral - ataxia Behavioral - muscle contraction or spasticity
- REFERENCE :
- HEPHD2 Handbook of Experimental Pharmacology. (Springer-Verlag, Heidelberger Pl. 3, D-1000 Berlin 33, Fed. Rep. Ger.) V.50- 1978- Volume(issue)/page/year: 55,527,1980
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Oral
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 660 mg/kg
- TOXIC EFFECTS :
- Behavioral - muscle weakness Behavioral - ataxia Behavioral - muscle contraction or spasticity
- REFERENCE :
- HEPHD2 Handbook of Experimental Pharmacology. (Springer-Verlag, Heidelberger Pl. 3, D-1000 Berlin 33, Fed. Rep. Ger.) V.50- 1978- Volume(issue)/page/year: 55,527,1980
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Intraperitoneal
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 140 mg/kg
- TOXIC EFFECTS :
- Behavioral - altered sleep time (including change in righting reflex) Behavioral - convulsions or effect on seizure threshold Lungs, Thorax, or Respiration - dyspnea
- REFERENCE :
- APPHAX Acta Poloniae Pharmaceutica. For English translation, see APPFAR. (Ars Polona, POB 1001, 00-680 Warsaw 1, Poland) V.1- 1937- Volume(issue)/page/year: 40,235,1983
- TYPE OF TEST :
- LD50 - Lethal dose, 50 percent kill
- ROUTE OF EXPOSURE :
- Intravenous
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 31 mg/kg
- TOXIC EFFECTS :
- Behavioral - muscle weakness Behavioral - ataxia Behavioral - muscle contraction or spasticity
- REFERENCE :
- HEPHD2 Handbook of Experimental Pharmacology. (Springer-Verlag, Heidelberger Pl. 3, D-1000 Berlin 33, Fed. Rep. Ger.) V.50- 1978- Volume(issue)/page/year: 55,527,1980 ** OTHER MULTIPLE DOSE TOXICITY DATA **
- TYPE OF TEST :
- TDLo - Lowest published toxic dose
- ROUTE OF EXPOSURE :
- Oral
- SPECIES OBSERVED :
- Rodent - rat
- DOSE/DURATION :
- 5760 mg/kg/22W-I
- TOXIC EFFECTS :
- Cardiac - EKG changes not diagnostic of specified effects Related to Chronic Data - death
- REFERENCE :
- ARZNAD Arzneimittel-Forschung. Drug Research. (Editio Cantor Verlag, Postfach 1255, W-7960 Aulendorf, Fed. Rep. Ger.) V.1- 1951- Volume(issue)/page/year: 30,1709,1980
- TYPE OF TEST :
- TDLo - Lowest published toxic dose
- ROUTE OF EXPOSURE :
- Oral
- SPECIES OBSERVED :
- Rodent - rat
- DOSE/DURATION :
- 650 mg/kg/7W-I
- TOXIC EFFECTS :
- Cardiac - EKG changes not diagnostic of specified effects
- REFERENCE :
- ARTODN Archives of Toxicology. (Springer-Verlag, Heidelberger Pl. 3, D-1000 Berlin 33, Fed. Rep. Ger.) V.32- 1974- Volume(issue)/page/year: 51,43,1982
- 毒理学数据:
毒性:小鼠口服LD50为480mg/kg,大鼠为1250mg/kg。
- 生态数据:
该物质对环境可能有危害,对水体应给予特别注意。
海关数据
中国海关编码:2921499090
- 概述:
- 2921499090 其他芳香单胺及衍生物及它们的盐. 增值税率:17.0% 退税率:9.0% 监管条件:无 最惠国关税:6.5% 普通关税:30.0%
- 申报要素:
- 品名, 成分含量, 用途
- 摘要/Summary:
- 2921499090 other aromatic monoamines and their derivatives; salts thereof VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0%
分子结构与计算化学数据
分子结构数据
1、 摩尔折射率:87.77
2、 摩尔体积(cm3/mol):256.7
3、 等张比容(90.2K):670.3
4、 表面张力(dyne/cm):46.4
5、 极化率(10-24cm3):34.79
计算化学数据
1.疏水参数计算参考值(XlogP):4.6
2.氢键供体数量:1
3.氢键受体数量:1
4.可旋转化学键数量:4
5.互变异构体数量:无
6.拓扑分子极性表面积12
7.重原子数量:21
8.表面电荷:0
9.复杂度:339
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