621-33-0

621-33-0结构式
621-33-0结构式
  • 常用中文名:间氨基苯乙醚
  • 常用英文名:3-Ethoxyaniline
  • CAS号:621-33-0
  • 分子式:C8H11NO
  • 分子量:137.179
  • 发布时间:2018-03-19 08:00:00
  • 更新时间:2024-01-02 20:00:52
  • 【用途一】
    用于有机合成。

化源商城直购

中文名 间氨基苯乙醚
英文名 3-Ethoxyaniline
中文别名 间乙氧基苯胺
3-乙氧基苯胺
3-氨基苯乙醚
英文别名 3-ethoxyphenylamine
m-ethoxyphenylamine
3-Ethoxybenzenamine
m-Phenetidine
Benzenamine,3-ethoxy
EINECS 210-680-2
Benzenamine, 3-ethoxy-
3-ethoxy aniline
3-Ethoxyaniline
m-Ethoxyaniline
MFCD00007785
密度 1.0±0.1 g/cm3
沸点 251.1±13.0 °C at 760 mmHg
分子式 C8H11NO
分子量 137.179
闪点 114.8±13.1 °C
精确质量 137.084061
PSA 35.25000
LogP 1.37
外观性状 淡黄色至暗红色液体
蒸汽压 0.0±0.5 mmHg at 25°C
折射率 1.545
储存条件

存放在密封容器内,放在阴凉,干燥处。

稳定性

避光

水溶解性 0.1-0.5 g/100 mL at 20 ºC
分子结构

1、 摩尔折射率:41.80

2、 摩尔体积(cm3/mol):132.2

3、 等张比容(90.2K):329.5

4、 表面张力(dyne/cm):38.5

5、 极化率(10-24cm3):16.57

计算化学

1.疏水参数计算参考值(XlogP):无

2.氢键供体数量:1

3.氢键受体数量:2

4.可旋转化学键数量:2

5.互变异构体数量:无

6.拓扑分子极性表面积35.2

7.重原子数量:10

8.表面电荷:0

9.复杂度:95.3

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:棕色透明液体。

2. 密度(g/mL,25/4℃):1.030

3. 相对蒸汽密度(g/mL,空气=1):未确定

4. 熔点(ºC):未确定

5. 沸点(ºC,常压):248

6. 沸点(ºC,5.2kPa):未确定

7. 折射率: 1.5655

8. 闪点(ºC):>112

9. 比旋光度(º):未确定

10. 自燃点或引燃温度(ºC):未确定

11. 蒸气压(kPa,25ºC):未确定

12. 饱和蒸气压(kPa,60ºC):未确定

13. 燃烧热(KJ/mol):未确定

14. 临界温度(ºC):未确定

15. 临界压力(KPa):未确定

16. 油水(辛醇/水)分配系数的对数值:未确定

17. 爆炸上限(%,V/V):未确定

18. 爆炸下限(%,V/V):未确定

19. 溶解性:未确定。

Name: m-Phenetidine 98% Material Safety Data Sheet
Synonym: 3-Ethoxybenzenamine; 3-Ethoxyaniline; Aniline, 3-ethoxy-; Benzenamine, 3-ethoxy-; m-Ethoxyanilin
CAS: 621-33-0
Section 1 - Chemical Product MSDS Name:m-Phenetidine 98% Material Safety Data Sheet
Synonym:3-Ethoxybenzenamine; 3-Ethoxyaniline; Aniline, 3-ethoxy-; Benzenamine, 3-ethoxy-; m-Ethoxyanilin

Section 2 - COMPOSITION, INFORMATION ON INGREDIENTS
CAS# Chemical Name content EINECS#
621-33-0 m-Phenetidine 98 210-680-2
Hazard Symbols: T
Risk Phrases: 23/24/25 33

Section 3 - HAZARDS IDENTIFICATION
EMERGENCY OVERVIEW
Toxic by inhalation, in contact with skin and if swallowed. Danger of cumulative effects.Cancer suspect agent.Light sensitive.Air sensitive.
Potential Health Effects
Eye:
May cause eye irritation. May cause chemical conjunctivitis.
Skin:
May cause skin irritation.
Ingestion:
May be harmful if swallowed. May form methemoglobin which in sufficient concentration causes cyanosis (bluish discoloration of skin due to deficient oxygenation of the blood).
Inhalation:
May be harmful if inhaled. Inhalation of aniline causes anoxia due to the formation of methemoglobin.
Chronic:
Effects may be delayed.

Section 4 - FIRST AID MEASURES
Eyes: Immediately flush eyes with plenty of water for at least 15 minutes, occasionally lifting the upper and lower eyelids. Get medical aid immediately.
Skin:
Get medical aid. Flush skin with plenty of water for at least 15 minutes while removing contaminated clothing and shoes.
Ingestion:
Never give anything by mouth to an unconscious person. Get medical aid immediately. Do NOT induce vomiting. If conscious and alert, rinse mouth and drink 2-4 cupfuls of milk or water.
Inhalation:
Remove from exposure and move to fresh air immediately. If not breathing, give artificial respiration. If breathing is difficult, give oxygen. Get medical aid.
Notes to Physician:

Section 5 - FIRE FIGHTING MEASURES
General Information:
As in any fire, wear a self-contained breathing apparatus in pressure-demand, MSHA/NIOSH (approved or equivalent), and full protective gear. During a fire, irritating and highly toxic gases may be generated by thermal decomposition or combustion.
Extinguishing Media:
In case of fire, use water, dry chemical, chemical foam, or alcohol-resistant foam.

Section 6 - ACCIDENTAL RELEASE MEASURES
General Information: Use proper personal protective equipment as indicated in Section 8.
Spills/Leaks:
Absorb spill using an absorbent, non-combustible material such as earth, sand, or vermiculite. Do not use combustible materials such as sawdust. Provide ventilation. Place under an inert atmosphere.

Section 7 - HANDLING and STORAGE
Handling:
Wash thoroughly after handling. Use with adequate ventilation. Do not get in eyes, on skin, or on clothing. Do not ingest or inhale.
Store protected from light. Handle under an inert atmosphere. Store protected from air. Do not breathe vapor.
Storage:
Keep containers tightly closed. Do not expose to air. Store protected from light. Store under an inert atmosphere. Store in a cool, dry area away from incompatible substances.

Section 8 - EXPOSURE CONTROLS, PERSONAL PROTECTION
Engineering Controls:
Facilities storing or utilizing this material should be equipped with an eyewash facility and a safety shower. Use adequate general or local exhaust ventilation to keep airborne concentrations below the permissible exposure limits.
Exposure Limits CAS# 621-33-0: Personal Protective Equipment Eyes: Wear appropriate protective eyeglasses or chemical safety goggles as described by OSHA's eye and face protection regulations in 29 CFR 1910.133 or European Standard EN166.
Skin:
Wear appropriate protective gloves and clothing to prevent skin exposure.
Clothing:
Wear appropriate protective clothing to prevent skin exposure.
Respirators:
A respiratory protection program that meets OSHA's 29 CFR 1910.134 and ANSI Z88.2 requirements or European Standard EN 149 must be followed whenever workplace conditions warrant respirator use.

Section 9 - PHYSICAL AND CHEMICAL PROPERTIES

Physical State: Clear liquid
Color: clear brown
Odor: None reported.
pH: Not available.
Vapor Pressure: Not available.
Viscosity: Not available.
Boiling Point: 248 deg C @ 760.00mmHg
Freezing/Melting Point: Not available.
Autoignition Temperature: Not applicable.
Flash Point: > 112 deg C (> 233.60 deg F)
Explosion Limits, lower: Not available.
Explosion Limits, upper: Not available.
Decomposition Temperature: Not available.
Solubility in water: Not available.
Specific Gravity/Density: 1.0320g/cm3
Molecular Formula: C8H11NO
Molecular Weight: 137.18

Section 10 - STABILITY AND REACTIVITY
Chemical Stability:
Stable under normal temperatures and pressures.
Conditions to Avoid:
Incompatible materials, light, exposure to air, excess heat.
Incompatibilities with Other Materials:
Air, acid anhydrides, acid chlorides, acids, chloroformates, direct light, strong oxidizing agents.
Hazardous Decomposition Products:
Nitrogen oxides, carbon monoxide, carbon dioxide.
Hazardous Polymerization: Has not been reported.

Section 11 - TOXICOLOGICAL INFORMATION
RTECS#:
CAS# 621-33-0: SI5400000 LD50/LC50:
Not available.
Carcinogenicity:
m-Phenetidine - Not listed by ACGIH, IARC, or NTP.
Other:
See actual entry in RTECS for complete information.

Section 12 - ECOLOGICAL INFORMATION
Other No information available.

Section 13 - DISPOSAL CONSIDERATIONS
Dispose of in a manner consistent with federal, state, and local regulations.

Section 14 - TRANSPORT INFORMATION

IATA
Shipping Name: PHENETIDINES
Hazard Class: 6.1
UN Number: 2311
Packing Group: III
IMO
Shipping Name: PHENETIDINES
Hazard Class: 6.1
UN Number: 2311
Packing Group: III
RID/ADR
Shipping Name: PHENETIDINES
Hazard Class: 6.1
UN Number: 2311
Packing group: III

Section 15 - REGULATORY INFORMATION

European/International Regulations
European Labeling in Accordance with EC Directives
Hazard Symbols: T
Risk Phrases:
R 23/24/25 Toxic by inhalation, in contact with skin
and if swallowed.
R 33 Danger of cumulative effects.
Safety Phrases:
S 28A After contact with skin, wash immediately with
plenty of water.
S 36/37 Wear suitable protective clothing and
gloves.
S 45 In case of accident or if you feel unwell, seek
medical advice immediately (show the label where
possible).
WGK (Water Danger/Protection)
CAS# 621-33-0: No information available.
Canada
CAS# 621-33-0 is listed on Canada's NDSL List.
CAS# 621-33-0 is not listed on Canada's Ingredient Disclosure List.
US FEDERAL
TSCA
CAS# 621-33-0 is listed on the TSCA inventory.


SECTION 16 - ADDITIONAL INFORMATION
N/A

生态学数据:

不要注入水渠。

CHEMICAL IDENTIFICATION

RTECS NUMBER :
SI5400000
CHEMICAL NAME :
m-Phenetidine
CAS REGISTRY NUMBER :
621-33-0
BEILSTEIN REFERENCE NO. :
0971028
LAST UPDATED :
199710
DATA ITEMS CITED :
3
MOLECULAR FORMULA :
C8-H11-N-O
MOLECULAR WEIGHT :
137.20

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

MUTATION DATA

TYPE OF TEST :
Mutation in microorganisms
TEST SYSTEM :
Bacteria - Salmonella typhimurium
DOSE/DURATION :
1 mg/plate
REFERENCE :
EMMUEG Environmental and Molecular Mutagenesis. (Alan R. Liss, Inc., 41 E. 11th St., New York, NY 10003) V.10- 1987- Volume(issue)/page/year: 11(Suppl 12),1,1988

符号 GHS06 GHS08
GHS06, GHS08
信号词 Danger
危害声明 H301 + H311 + H331-H373
警示性声明 P261-P280-P301 + P310-P311
个人防护装备 Eyeshields;Faceshields;full-face respirator (US);Gloves;multi-purpose combination respirator cartridge (US);type ABEK (EN14387) respirator filter
危害码 (欧洲) T:Toxic;
风险声明 (欧洲) R23/24/25;R33
安全声明 (欧洲) S28-S36/37/39-S45-S36/37-S28A
危险品运输编码 UN 2311 6.1/PG 3
WGK德国 3
RTECS号 SI5400000
包装等级 III
危险类别 6.1(b)
海关编码 29222200

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文献:Journal fuer Praktische Chemie (Leipzig), , vol. <2>96, p. 25

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文献:Prasad; Gowda, Shankare; Gowda, D. Channe Synthetic Communications, 2004 , vol. 34, # 1 p. 1 - 10

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文献:Collection of Czechoslovak Chemical Communications, , vol. 54, # 7 p. 1846 - 1853

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文献:Bulletin de la Societe Chimique de France, , vol. <4>17, p. 407

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文献:Bulletin de la Societe Chimique de France, , vol. <4>17, p. 407

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文献:Journal of the American Chemical Society, , vol. 61, p. 384,385

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文献:Journal of the Chemical Society, , p. 2955

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文献:Journal fuer Praktische Chemie (Leipzig), , vol. <2> 32, p. 71

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文献:Journal fuer Praktische Chemie (Leipzig), , vol. <2>96, p. 25

由间氨基酚经乙酰化、烷基化、水解、中和而得。1.乙酰化将间氨基酚加入乙酸中,加热回流8h。回收乙酸后,水析,冷后过滤即得乙酰氨基酚([621-42-1])。2.烷基化将乙醇、氢氧化钠、间乙酰氨基酚、溴乙烷加入反应器中,加热回流8h,倒入水中冷却过滤,得间乙酰氨基苯乙醚。3.水解、中和将间乙酰氨基苯乙醚与工业盐酸混合,于水浴加热8h,然后倒入水中,用40%氢氧化钠中和至碱性。分出油层。水溶液用乙醚提取,回收乙醚后与油层一起减压蒸馏,在氮气保护下收集140-144℃(2.0kPa)馏分,即为间乙氧基苯胺。

海关编码 2922299090
中文概述 2922299090. 其他氨基(萘酚、酚)及醚、酯〔包括它们的盐, 但含有一种以上含氧基的除外〕. 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:30.0%
申报要素 品名, 成分含量, 用途, 乙醇胺及其盐应报明色度, 乙醇胺及其盐应报明包装
Summary 2922299090. other amino-naphthols and other amino-phenols, other than those containing more than one kind of oxygen function, their ethers and esters; salts thereof. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0%