625-36-5 (3-氯丙酰氯,3-chloropropanoyl chloride)

CAS号:
625-36-5
中文名称:
3-氯丙酰氯
英文名称:
3-chloropropanoyl chloride
安全信息:
分子式:
C3H4Cl2O
分子量:
126.969259262085

3-氯丙酰氯(625-36-5)名称与标识符

名称

中文别名:
3-氯丙酰氯;β-氯丙酰氯;3-氯代丙酰氯;3-Chloropropionyl Chloride 3-氯丙酰氯;3-氯丙酰氯(β-氯丙酰氯);3-氯化丙酰氯;
英文别名:
3-Chloropropionyl chloride;3-Chloropropanoyl chloride;3-chloro propionic acid chloride;3-chloro-n-propionyl chloride;3-chloro-propanoylchlorid;3-Chloropropinyl chloride;3-Chloropropionyl ch;3-Chloropropionyl chlorode;3-Chlorpropionylchlorid;b-Chloropropanoyl chloride;Chloropropionyl chloride;Propionylchloride, 3-chloro- (6CI,7CI,8CI);(Chloromethyl)acetyl chloride;NSC 84180;b-Chloropropionic acid chloride;b-Chloropropionyl chloride;w-Chloropropanoyl chloride;w-Chloropropionyl chloride;3-Chloropropionic acid chloride;3-Chloropropionylchloride;b-Chloropropanoylchloride;Propanoyl chloride, 3-chloro-;Propionyl chloride, 3-chloro-;beta-Chloropropionyl chloride;Propanoylchloride, 3-chloro-;.beta.-Chloropropionyl chloride;.beta.-Chloropropanoyl chloride;.beta.-Chloropropionoyl chloride;INUNLMUAPJVRME-UHFFFAOYSA-N;24PO18998I;ss-Chloropropionyl Chloride;

标识符

MDL:
MFCD00000747
InChIKey:
INUNLMUAPJVRME-UHFFFAOYSA-N
Inchi:
1S/C3H4Cl2O/c4-2-1-3(5)6/h1-2H2
SMILES:
ClCCC(=O)Cl
BRN:
635814

3-氯丙酰氯(625-36-5)物化性质

实验特性

  • LogP : 1.38070
  • PSA : 17.07000
  • 折射率 : 1.456-1.458
  • 水溶性 : 起反应
  • 沸点 : 144°C(lit.)
  • 熔点 : -32 ºC
  • 闪点 : 49 ºC
  • FEMA : 3536
  • 颜色与性状 : 无色液体。
  • PH值 : <7 (H2O)
  • 溶解性 : 微溶于水。
  • 敏感性 : Moisture Sensitive
  • 密度 : 1.33

计算特性

  • 精确分子量 : 125.96400
  • 氢键供体数量 : 0
  • 氢键受体数量 : 1
  • 可旋转化学键数量 : 2
  • 同位素质量 : 125.964
  • 重原子数量 : 6
  • 复杂度 : 52.8
  • 同位素原子数量 : 0
  • 确定原子立构中心数量 : 0
  • 不确定原子立构中心数量 : 0
  • 确定化学键立构中心数量 : 0
  • 不确定化学键立构中心数量 : 0
  • 共价键单元数量 : 1
  • 疏水参数计算参考值(XlogP) : 1.3
  • 互变异构体数量 : 无
  • 表面电荷 : 0
  • 拓扑分子极性表面积 : 17.1

3-氯丙酰氯(625-36-5)安全信息

3-氯丙酰氯(625-36-5)国际标准相关数据

EINECS:
84180

3-氯丙酰氯(625-36-5)海关数据

海关编码:
29159080
海关数据:

中国海关编码:

2915900090

概述:

2915900090. 其他饱和无环一元羧酸及其酸酐(酰卤、过氧)化物、过氧酸及其卤化、硝化、磺化、亚硝化衍生物. 增值税率:17.0%. 退税率:9.0%. 监管条件:AB(入境货物通关单,出境货物通关单). 最惠国关税:5.5%. 普通关税:30.0%

申报要素:

品名, 成分含量, 用途

监管条件:

A.入境货物通关单
B.出境货物通关单

检验检疫类别:

R.进口食品卫生监督检验
S.出口食品卫生监督检验
M.进口商品检验
N.出口商品检验

Summary:

2915900090 other saturated acyclic monocarboxylic acids and their anhydrides, halides, peroxides and peroxyacids; their halogenated, sulphonated, nitrated or nitrosated derivatives VAT:17.0% Tax rebate rate:9.0% Supervision conditions:AB(certificate of inspection for goods inward,certificate of inspection for goods outward) MFN tariff:5.5% General tariff:30.0%

3-氯丙酰氯(625-36-5)相关文献

3-氯丙酰氯(625-36-5)参考资料

Reaxys RN:
635814
Beilstein:
2,250
PubChem CID:

3-氯丙酰氯(625-36-5) MSDS

基础信息

Name: 3-Chloropropionyl Chloride 98% Material Safety Data Sheet
Synonym: None
CAS: 625-36-5
Section 1 - Chemical Product ? MSDS Name:3-Chloropropionyl Chloride 98% Material Safety Data Sheet
Synonym:None

Section 2 - COMPOSITION, INFORMATION ON INGREDIENTS
CAS# Chemical Name content EINECS#
625-36-5 3-CHLOROPROPIONYL CHLORIDE 98 210-890-4
Hazard Symbols: T+ C
Risk Phrases: 10 14 26 35

Section 3 - HAZARDS IDENTIFICATION
? EMERGENCY OVERVIEW
Flammable. Reacts violently with water. Very toxic by inhalation.
Causes severe burns.Corrosive.Lachrymator (substance which increases the flow of tears).
Potential Health Effects
Eye:
Causes eye burns. Lachrymator (substance which increases the flow of tears).
Skin:
Causes severe burns with delayed tissue destruction.
Ingestion:
May cause severe and permanent damage to the digestive tract. Causes gastrointestinal tract burns.
Inhalation:
Causes chemical burns to the respiratory tract. Inhalation may be fatal as a result of spasm, inflammation, edema of the larynx and bronchi, chemical pneumonitis and pulmonary edema. Vapors may cause dizziness or suffocation.
Chronic:
None

Section 4 - FIRST AID MEASURES
? Eyes: Get medical aid immediately. Do NOT allow victim to rub eyes or keep eyes closed. Extensive irrigation with water is required (at least 30 minutes).
Skin:
Get medical aid immediately. Immediately flush skin with plenty of water for at least 15 minutes while removing contaminated clothing and shoes. Wash clothing before reuse. Destroy contaminated shoes.
Ingestion:
Do not induce vomiting. If victim is conscious and alert, give 2-4 cupfuls of milk or water. Never give anything by mouth to an unconscious person. Get medical aid immediately.
Inhalation:
Get medical aid immediately. Remove from exposure and move to fresh air immediately. If not breathing, give artificial respiration. If breathing is difficult, give oxygen. Do NOT use mouth-to-mouth resuscitation.
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. Vapors may form an explosive mixture with air.
Vapors can travel to a source of ignition and flash back. During a fire, irritating and highly toxic gases may be generated by thermal decomposition or combustion. Water Reactive. Material will react with water and may release a flammable and/or toxic gas. Use water spray to keep fire-exposed containers cool. Containers may explode in the heat of a fire. Flammable liquid and vapor. Vapors may be heavier than air. They can spread along the ground and collect in low or confined areas. May ignite or explode on contact with steam or moist air.
Extinguishing Media:
Use dry sand or earth to smother fire. Do NOT use water directly on fire. Use water spray to cool fire-exposed containers. Use foam, dry chemical, or carbon dioxide. Do NOT use straight streams of water.
Contact professional fire-fighters immediately.

Section 6 - ACCIDENTAL RELEASE MEASURES
? General Information: Use proper personal protective equipment as indicated in Section 8.
Spills/Leaks:
Absorb spill with inert material (e.g. vermiculite, sand or earth), then place in suitable container. Clean up spills immediately, observing precautions in the Protective Equipment section. Remove all sources of ignition. Use a spark-proof tool. Provide ventilation. Do not expose spill to water. A vapor suppressing foam may be used to reduce vapors.

Section 7 - HANDLING and STORAGE
? Handling:
Do not allow water to get into the container because of violent reaction. Ground and bond containers when transferring material. Use spark-proof tools and explosion proof equipment. Do not breathe dust, vapor, mist, or gas. Do not get in eyes, on skin, or on clothing.
Empty containers retain product residue, (liquid and/or vapor), and can be dangerous. Keep container tightly closed. Keep away from heat, sparks and flame. Use with adequate ventilation. Use only in a chemical fume hood. Discard contaminated shoes. Do not pressurize, cut, weld, braze, solder, drill, grind, or expose empty containers to heat, sparks or open flames.
Storage:
Keep away from heat, sparks, and flame. Keep away from sources of ignition. Store in a cool, dry place. Keep container closed when not in use. Store in a tightly closed container. Keep away from water.
Flammables-area.

Section 8 - EXPOSURE CONTROLS, PERSONAL PROTECTION
? Engineering Controls:
Use explosion-proof ventilation equipment. Facilities storing or utilizing this material should be equipped with an eyewash facility and a safety shower. Use adequate ventilation to keep airborne concentrations low.
Exposure Limits CAS# 625-36-5: 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 to prevent skin exposure.
Clothing:
Wear appropriate protective clothing to minimize contact with skin.
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: Liquid
Color: clear, colorless
Odor: Stench
pH: Not available.
Vapor Pressure: 10 mbar @ 20 deg C
Viscosity: 1.4 mPas 20 deg C
Boiling Point: 143 - 145 deg C @ 760.00mm Hg
Freezing/Melting Point: -32 deg C
Autoignition Temperature: 490 deg C ( 914.00 deg F)
Flash Point: 30 deg C ( 86.00 deg F)
Explosion Limits, lower: 8.80 vol %
Explosion Limits, upper: 20.20 vol %
Decomposition Temperature: 30 deg C
Solubility in water:
Specific Gravity/Density: 1.3300g/cm3
Molecular Formula: C3H4Cl2O
Molecular Weight: 126.97

Section 10 - STABILITY AND REACTIVITY
? Chemical Stability:
Combines vigorously or explosively with water.
Conditions to Avoid:
Incompatible materials, ignition sources, excess heat, exposure to moist air or water.
Incompatibilities with Other Materials:
Acids, oxidizing materials, water.
Hazardous Decomposition Products:
Hydrogen chloride, phosgene, carbon monoxide, carbon dioxide.
Hazardous Polymerization: Has not been reported.

Section 11 - TOXICOLOGICAL INFORMATION
? RTECS#:
CAS# 625-36-5 unlisted.
LD50/LC50:
Not available.
Not available.
Carcinogenicity:
3-CHLOROPROPIONYL CHLORIDE - Not listed by ACGIH, IARC, or NTP.

Section 12 - ECOLOGICAL INFORMATION
?

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

Section 14 - TRANSPORT INFORMATION
?
IATA
Shipping Name: TOXIC LIQUID, CORROSIVE, ORGANIC, N.O.S.*
Hazard Class: 6.1 (8)
UN Number: 2927
Packing Group: II
IMO
Shipping Name: TOXIC LIQUID, CORROSIVE, ORGANIC, N.O.S.
Hazard Class: 6.1 (8)
UN Number: 2927
Packing Group: II
RID/ADR
Shipping Name: TOXIC LIQUID, CORROSIVE, ORGANIC, N.O.S.
Hazard Class: 6.1
UN Number: 2927
Packing group: II

Section 15 - REGULATORY INFORMATION
?
European/International Regulations
European Labeling in Accordance with EC Directives
Hazard Symbols: T+ C
Risk Phrases:
R 10 Flammable.
R 14 Reacts violently with water.
R 26 Very toxic by inhalation.
R 35 Causes severe burns.
Safety Phrases:
S 8 Keep container dry.
S 9 Keep container in a well-ventilated place.
S 16 Keep away from sources of ignition - No
smoking.
S 33 Take precautionary measures against static
discharges.
S 36/37/39 Wear suitable protective clothing, gloves
and eye/face protection.
S 38 In case of insufficient ventilation, wear
suitable respiratory equipment.
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# 625-36-5: 1
Canada
CAS# 625-36-5 is listed on Canada's NDSL List.
CAS# 625-36-5 is not listed on Canada's Ingredient Disclosure List.
US FEDERAL
TSCA
CAS# 625-36-5 is listed on the TSCA inventory.


SECTION 16 - ADDITIONAL INFORMATION
N/A