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132539-06-1生产厂家

132539-06-1价格

132539-06-1

132539-06-1结构式
132539-06-1结构式

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中文名 奥氮平
英文名 olanzapine
中文别名 奥兰扎平
2-甲基-4-(4-甲基-1-哌嗪基)-10H-噻吩并[2,3-b][1,5]苯并二氮杂
2-甲基-4-(4-甲基-1-哌嗪基)-10H-thieno[2,3-b][1,5]苯二氮
英文别名 10H-thieno2,3-b1,5benzodiazepine, 2-methyl-4-(4-methyl-1-piperazinyl)-
Olanzapine
2-Methyl-4-(4-methyl-1-piperazinyl)- 10H-thieno[2,3-b][1,5]benzodiazepine
2-Methyl-4-(4-methylpiperazin-1-yl)-10H-thieno[2,3-b][1,5]benzodiazepine
2-Methyl-4-(4-methylpiperazin-1-yl)-10H-benzo[b]thieno[2,3-e][1,4]diazepine
2-méthyl-4-(4-méthylpipérazin-1-yl)-10H-thiéno[2,3-b][1,5]benzodiazépine
2-Methyl-4-(4-methyl-1-piperazinyl)- 10H-thieno[2,3-b][1,5]benzodiazepine LY-170053
Integrol
Oltal
Larmac
ZYPREXA
OLANZAPINE FORM I
2-Methyl-4-(4-methyl-1-piperazinyl)-10H-thieno[2,3-b][1,5]benzodiazepine
2-methyl-4-(4-methylpiperazin-1-yl)-10H-thieno2,3-b1,5benzodiazepine
lanzac
Oleanz
10H-Thieno[2,3-b][1,5]benzodiazepine, 2-methyl-4-(4-methyl-1-piperazinyl)-
2-Methyl-4-(4-methylpiperazin-1-yl)-10H-thieno[2,3-b][1,5]benzodiazepin
Oliza
MFCD00866702
EINECS 200-835-2
密度 1.3±0.1 g/cm3
沸点 476.0±55.0 °C at 760 mmHg
熔点 195°C
分子式 C17H20N4S
分子量 312.432
闪点 241.7±31.5 °C
精确质量 312.140869
PSA 59.11000
LogP 2.18
外观性状 淡黄色结晶粉末
蒸汽压 0.0±1.2 mmHg at 25°C
折射率 1.709
储存条件 -20°C Freezer
分子结构

1、 摩尔折射率:92.15

2、 摩尔体积(cm3/mol):235.9

3、 等张比容(90.2K):633.7

4、 表面张力(dyne/cm):52.0

5、 极化率(10-24cm3):36.53

计算化学

1.疏水参数计算参考值(XlogP):2.8

2.氢键供体数量:1

3.氢键受体数量:5

4.可旋转化学键数量:1

5.互变异构体数量:3

6.拓扑分子极性表面积56.2

7.重原子数量:22

8.表面电荷:0

9.复杂度:543

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

更多

1.性状:从乙腈结晶。

2.熔点:195℃。

Olanzapine Revision number: 5
SAFETY DATA SHEET

Section1. IDENTIFICATION
Product name:Olanzapine

Revision number:5

Section2. HAZARDS IDENTIFICATION
GHS classification
PHYSICAL HAZARDSNot classified
HEALTH HAZARDS
Acute toxicity (Oral)Category 3
Category 2
Skin corrosion/irritation
Serious eye damage/eye irritationCategory 2A
Not classified
ENVIRONMENTAL HAZARDS
GHS label elements, including precautionary statements
Pictograms or hazard symbols
Signal wordDanger
Hazard statementsToxic if swallowed
Causes skin irritation
Causes serious eye irritation
Precautionary statements:
Do not eat, drink or smoke when using this product.
[Prevention]
Wash hands thoroughly after handling.
Wear protective gloves/eye protection/face protection.
[Response]IF SWALLOWED: Immediately call a POISON CENTER or doctor/physician. Rinse
mouth.
IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses,
if present and easy to do. Continue rinsing.
If eye irritation persists: Get medical advice/attention.
IF ON SKIN: Gently wash with plenty of soap and water.
If skin irritation occurs: Get medical advice/attention.
Take off contaminated clothing and wash before reuse.
[Storage]Store locked up.
[Disposal]Dispose of contents/container through a waste management company authorized by
the local government.

Section3. COMPOSITION/INFORMATION ON INGREDIENTS
Substance/mixture:Substance
Olanzapine
Components:
Olanzapine

Section3. COMPOSITION/INFORMATION ON INGREDIENTS
Percent:>98.0%(GC)(T)
CAS Number:132539-06-1
Synonyms:2-Methyl-4-(4-methyl-1-piperazinyl)-10H-thieno[2,3-b][1,5]benzodiazepine
Chemical Formula:C17H20N4S

Section4. FIRST AID MEASURES
Remove victim to fresh air and keep at rest in a position comfortable for breathing.
Inhalation:
Get medical advice/attention if you feel unwell.
Remove/Take off immediately all contaminated clothing. Gently wash with plenty of
Skin contact:
soap and water. If skin irritation or rash occurs: Get medical advice/attention.
Eye contact:Rinse cautiously with water for several minutes. Remove contact lenses, if present
and easy to do. Continue rinsing. If eye irritation persists: Get medical
advice/attention.
Ingestion:Immediately call a POISON CENTER or doctor/physician. Rinse mouth.
Protection of first-aiders:A rescuer should wear personal protective equipment, such as rubber gloves and air-
tight goggles.

Section5. FIRE-FIGHTING MEASURES
Suitable extinguishingDry chemical, foam, water spray, carbon dioxide.
media:
Specific hazards arising Take care as it may decompose upon combustion or in high temperatures to
from the chemical:generate poisonous fume.
Precautions for firefighters: Fire-extinguishing work is done from the windward and the suitable fire-extinguishing
method according to the surrounding situation is used. Uninvolved persons should
evacuate to a safe place. In case of fire in the surroundings: Remove movable
containers if safe to do so.
Special protectiveWhen extinguishing fire, be sure to wear personal protective equipment.
equipment for firefighters:

Section6. ACCIDENTAL RELEASE MEASURES
Use extra personal protective equipment (P3 filter respirator for toxic particles). Keep
Personal precautions,
protective equipment and people away from and upwind of spill/leak. Entry to non-involved personnel should
emergency procedures: be controlled around the leakage area by roping off, etc.
Environmental precautions: Prevent product from entering drains.
Methods and materials for Sweep dust to collect it into an airtight container, taking care not to disperse it.
containment and cleaning Adhered or collected material should be promptly disposed of, in accordance with
up: appropriate laws and regulations.

Section7. HANDLING AND STORAGE
Precautions for safe handling
Technical measures:Handling is performed in a well ventilated place. Wear suitable protective equipment.
Prevent dispersion of dust. Wash hands and face thoroughly after handling.
Use a closed system if possible. Use a local exhaust if dust or aerosol will be
generated.
Advice on safe handling: Avoid contact with skin, eyes and clothing.
Conditions for safe storage, including any
incompatibilities
Storage conditions:Keep container tightly closed. Store in a refrigerator.
Store locked up.
Store away from incompatible materials such as oxidizing agents.
Heat-sensitive
Packaging material:Comply with laws.

Section8. EXPOSURE CONTROLS / PERSONAL PROTECTION
Engineering controls:Install a closed system or local exhaust. Also install safety shower and eye bath.
Personal protective equipment
Olanzapine

Section8. EXPOSURE CONTROLS / PERSONAL PROTECTION
Respiratory protection: Dust respirator, self-contained breathing apparatus(SCBA), supplied air respirator,
etc. Use respirators approved under appropriate government standards and follow
local and national regulations.
Hand protection:Impervious gloves.
Eye protection:Safety goggles. A face-shield, if the situation requires.
Skin and body protection: Impervious protective clothing. Protective boots, if the situation requires.

Section9. PHYSICAL AND CHEMICAL PROPERTIES
Solid
Physical state (20°C):
Form:Crystal- Powder
Colour:Pale yellow - Deep yellow
Odour:No data available
pH: No data available
Melting point/freezing point:194°C (dec.)
Boiling point/range:No data available
Flash point:No data available
Flammability or explosive
limits:
Lower:No data available
Upper:No data available
Relative density:No data available
Solubility(ies):
[Water]Insoluble
[Other solvents]
Soluble:Hot acetone
Log Pow:4.09

Section10. STABILITY AND REACTIVITY
Chemical stability:Stable under proper conditions.
Possibility of hazardous No special reactivity has been reported.
reactions:
Incompatible materials: Oxidizing agents
Hazardous decomposition Carbon monoxide, Carbon dioxide, Nitrogen oxides (NOx), Sulfur oxides
products:

Section11. TOXICOLOGICAL INFORMATION
Acute Toxicity:orl-man LDLo:7067 ug/kg
Skin corrosion/irritation: No data available
Serious eyeNo data available
damage/irritation:
Germ cell mutagenicity: No data available
Carcinogenicity:
IARC =No data available
NTP =No data available
Reproductive toxicity:No data available
RTECS Number:XJ9007750

Section12. ECOLOGICAL INFORMATION
Ecotoxicity:
Fish:No data available
No data available
Crustacea:
Algae:No data available
Persistence / degradability: No data available
BioaccumulativeNo data available
potential(BCF):
Mobility in soil
Olanzapine

Section12. ECOLOGICAL INFORMATION
Log Pow:4.09
Soil adsorption (Koc): No data available
Henry's LawNo data available
constant(PaM3/mol):

Section13. DISPOSAL CONSIDERATIONS
Recycle to process, if possible. Consult your local regional authorities. You may be able to dissolve or mix material
with a combustible solvent and burn in a chemical incinerator equipped with an afterburner and scrubber system.
Observe all federal, state and local regulations when disposing of the substance.

Section14. TRANSPORT INFORMATION
Hazards Class:6.1: Toxic substance.
UN-No:2811
Proper shipping name:Toxic solid, organic, n.o.s.
Packing group:III

Section15. REGULATORY INFORMATION
Safe management ordinance of dangerous chemical product (State Council announces on January 26, 2002
and revised on February 16,2011): Safe use and production, the storage of a dangerous chemical, transport,
loading and unloading were prescribed.


SECTION 16 - ADDITIONAL INFORMATION
N/A
符号 GHS07
GHS07
信号词 Warning
危害声明 H315-H319
警示性声明 P305 + P351 + P338
危害码 (欧洲) Xi,Xn,F
风险声明 (欧洲) 36/38-36-20/21/22-11
安全声明 (欧洲) S22-S24/25
危险品运输编码 UN 2811 6.1 / PGIII
WGK德国 3
海关编码 2934999090

1. 4-氨基-2-甲基-10H-噻吩并[2,3-b][1,5]苯并二氮杂革盐酸盐和N-甲基哌嗪,在二甲亚砜和甲苯中,氮气保护下回流20h,得到奥氮平。

132539-06-1 preparation

2. 2-氨基-3-氰基-5-甲基噻吩的制备

在反应瓶中加入硫21.8g(0.68mol)、丙醛47.3g(0.81mol)和DMA135ml,搅拌溶解,5~10ºC滴加三乙胺57.6g(0.61mol),约30min加完,于18~20ºC搅拌1h.滴加丙二腈45g(0.68mol)的DMF90ml溶液,约1h加完,继续于15~20ºC搅拌反应1h.将反应液倾入冰水中,产生黄色沉淀,稍放置,过滤,水洗,干燥,得黄色固体2-氨基-3-氰基-5-甲基噻吩70g,收率74.6%,mp99~100ºC.

3. 2-(邻硝基苯氨基)-3-氰基-5-甲基噻吩的制备

在反应瓶中加入邻氯硝基苯28.2g(0.2mol)、2-氨基-3-氰基-5-甲基噻吩27.6g(0.2mol)、LiOH12.4g(0.3mol)和DMF150ml,于70 ºC搅拌反应6h.冷却,倒入碎冰中,用二氯甲烷(500×3)提取,用2mol/L盐酸100ml洗,水(200ml×2)洗,无水MgSO4干燥,减压蒸除回收溶剂,剩余物用乙醇重结晶,得黄色结晶2-(邻硝基苯氨基)-3-氰基-5-甲基噻吩35g, 收率70%,mp99~101ºC.

4. 2-甲基-4-氨基-10H-噻吩并[2,3-b][1,5]苯二氮杂盐酸盐的制备

在反应瓶中加入乙醇600ml和2-(邻硝基苯氨基)-3-氰基-5-甲基噻吩60g(0.23mol),于50 ºC搅拌10min.于10min内加入二水氯化亚锡170g(0.75mol)的6mol/L盐酸500ml的溶液,搅拌回流1h.减压蒸除乙醇,自然冷却,析晶,过滤,用少量水洗滤饼,再用少量丙酮洗至呈黄色,抽干,干燥,得黄色固体2-甲基-4-氨基-10H-噻吩并[2,3-b][1,5]苯二氮杂盐酸盐50g,收率82%,mp>250ºC.

5. 奥氮平的合成

在反应瓶中加入2-甲基-4-氨基-10H-噻吩并[2,3-b][1,5]苯二氮杂盐酸盐50g(0.19mol)、无水哌嗪200g(2.3mol)、DMSO250ml和甲苯250ml,搅拌溶解,搅拌回流20h.冷至50 ºC,倾入冰水1000ml中,放置析晶,过滤,水洗,抽干,干燥,得黄色固体.将固体加到反应瓶中,再加入DMSO500ml、37%甲醛14.6g(0.18mol)和98%甲酸8.5g(0.18mol),于80 ºC搅拌2h.倾入冰水中析晶,过滤,水洗,干燥得粗品奥氮平50g,用乙醇500ml重结晶,得奥氮平纯品40g,收率68%,mp193~195 ºC.

132539-06-1 preparation

海关编码 2934999090
中文概述 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
Summary 2934999090. other heterocyclic compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%