4704-77-2 (3-溴-1,2-丙二醇,3-Bromo-1,2-propanediol)

CAS号:
4704-77-2
中文名称:
3-溴-1,2-丙二醇
英文名称:
3-Bromo-1,2-propanediol
安全信息:
分子式:
C3H7BrO2
分子量:
154.990480661392
相关分类:

3-溴-1,2-丙二醇(4704-77-2)名称与标识符

名称

中文别名:
3-溴-1,2-丙二醇;3-溴-1,2-并二酚;间溴硝基苯;
英文别名:
3-Bromopropane-1,2-diol;3-Bromo-1,2-Propanediol;1,2-Propanediol,3-bromo-;3-Bromo-;3-BROMO-1,2-PROPANEDIOL,PALE YELLOW LIQUID;3-bromo-2-propanediol;C3H7BrO2;3-Bromo-1,2-propanediol, 97%;AKOS015916343;1ST15326;Bromodeoxyglycerol;BP-21425;FT-0615240;3-Bromodeoxyglycerol;bromopropane-2,3-diol;BS-28661;FT-0690329;CHEBI:18719;Glycerol bromohydrin;NS00044992;bromomethyl ethylene glycol;Q27109088;Monobromoglycerol;2-01-00-00540 (Beilstein Handbook Reference);SB47699;alpha-Bromohydrin;1,2-Propanediol, 3-bromo-;D84178;(RS)-3-bromo-1,2-propanediol;SCHEMBL370747;3-bromo-propane-1,2-diol;1-BROMO-2,3-DIHYDROXYPROPANE;(+/-)-Glycerol 1-bromohydrin;FT-0694613;CHEMBL3276497;UNII-AS532NK8NE;EINECS 225-186-2;2,3-dihydroxyl-n-propyl bromide;AS532NK8NE;EN300-214063;4704-77-2;MFCD00004711;3-Bromo-1,2-propanediol, technical, >=96% (GC);.alpha.-Bromohydrin;DTXSID20963729;SB46822;BRN 1719124;3-bromo-propan-1,2-diol;1-Bromo-2,3-propanediol;DTXCID601021067;(A+-)-Glycerol 1-bromohydrin;

标识符

MDL:
MFCD00004711
InChIKey:
SIBFQOUHOCRXDL-UHFFFAOYSA-N
Inchi:
1S/C3H7BrO2/c4-1-3(6)2-5/h3,5-6H,1-2H2
SMILES:
BrCC(CO)O

3-溴-1,2-丙二醇(4704-77-2)物化性质

实验特性

  • LogP : -0.26550
  • PSA : 40.46000
  • 折射率 : n20/D 1.518(lit.)
  • 沸点 : 72-75 °C0.2 mm Hg(lit.)
  • 熔点 : No data available
  • 蒸气压 : 0.0±1.1 mmHg at 25°C
  • 闪点 : >230 °F
  • 颜色与性状 : 无色或黄色粘稠液体
  • 溶解性 : 未确定
  • 密度 : 1.771 g/mL at 25 °C(lit.)

计算特性

  • 精确分子量 : 153.96300
  • 氢键供体数量 : 2
  • 氢键受体数量 : 2
  • 可旋转化学键数量 : 2
  • 同位素质量 : 153.962942
  • 重原子数量 : 6
  • 复杂度 : 32
  • 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 : 1
  • 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) : -0.3
  • 互变异构体数量 : 无
  • 表面电荷 : 0
  • 拓扑分子极性表面积 : 40.5

3-溴-1,2-丙二醇(4704-77-2)安全信息

3-溴-1,2-丙二醇(4704-77-2)国际标准相关数据

EINECS:
225-186-2

3-溴-1,2-丙二醇(4704-77-2)推荐厂家 更多厂家(40)

公司名称手机号/电话联系人QQ微信询单
湖北永阔科技有限公司 18771920143
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郭经理 1248580055
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上海源叶生物科技有限公司 15026964105
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郑州阿尔法化工有限公司 15324716602
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西安德而塔生物科技有限公司 18133906270
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张思胧 1400858822
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湖北拓邦化工有限公司 15102763473
027-59106185
涂梦婷 1400868822/1248089955
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天门恒昌化工有限公司 15102714773
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雷经理 1178380033
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巨胜化学研究院 18064118002
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3-溴-1,2-丙二醇(4704-77-2)相关文献

3-溴-1,2-丙二醇(4704-77-2)参考资料

Beilstein:
1719124
PubChem CID:

3-溴-1,2-丙二醇(4704-77-2) MSDS

基础信息

Name:3-Bromo-1 2-Propanediol 97% Material Safety Data Sheet
Synonym:Bromodeoxyglycerol; Alpha-Bromohydrin; Glycerol Bromohydrin; Monobromoglycerol
CAS:4704-77-2
Section 1 - Chemical Product ? MSDS Name:3-Bromo-1 2-Propanediol 97% Material Safety Data Sheet
Synonym:Bromodeoxyglycerol; Alpha-Bromohydrin; Glycerol Bromohydrin; Monobromoglycerol

Section 2 - COMPOSITION, INFORMATION ON INGREDIENTS
CAS#Chemical NamecontentEINECS#
4704-77-23-Bromo-1,2-Propanediol97%225-186-2
Hazard Symbols: XI
Risk Phrases: 36/37/38

Section 3 - HAZARDS IDENTIFICATION
? EMERGENCY OVERVIEW
Irritating to eyes, respiratory system and skin.
Potential Health Effects
Eye:
Causes eye irritation. May cause chemical conjunctivitis.
Skin:
Causes skin irritation.
Ingestion:
May cause gastrointestinal irritation with nausea, vomiting and diarrhea.
Inhalation:
Causes respiratory tract irritation. Can produce delayed pulmonary edema.
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.
Skin:
Get medical aid. Flush skin with plenty of water for at least 15 minutes while removing contaminated clothing and shoes. Wash clothing before reuse.
Ingestion:
Never give anything by mouth to an unconscious person. Get medical aid. 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 breathing is difficult, give oxygen. Get medical aid. Do NOT use mouth-to-mouth resuscitation. If breathing has ceased apply artificial respiration using oxygen and a suitable mechanical device such as a bag and a mask.
Notes to Physician:
Treat symptomatically and supportively.

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. Vapors may be heavier than air. They can spread along the ground and collect in low or confined areas. Runoff from fire control or dilution water may cause pollution.
Extinguishing Media:
Use water spray to cool fire-exposed containers. Use water spray, dry chemical, carbon dioxide, or appropriate foam.

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. Avoid runoff into storm sewers and ditches which lead to waterways. Clean up spills immediately, observing precautions in the Protective Equipment section. Provide ventilation.

Section 7 - HANDLING and STORAGE
? Handling:
Avoid breathing dust, vapor, mist, or gas. Avoid contact with eyes, skin, and clothing. Keep container tightly closed. Avoid ingestion and inhalation. Use with adequate ventilation. Wash clothing before reuse.
Storage:
Store in a tightly closed container. Store in a cool, dry, well-ventilated area away from incompatible substances. Keep refrigerated. (Store below 4C/39F.)

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 ventilation to keep airborne concentrations low.
Exposure Limits CAS# 4704-77-2: 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 prevent skin exposure.
Respirators:
Follow the OSHA respirator regulations found in 29 CFR 1910.134 or European Standard EN 149. Use a NIOSH/MSHA or European Standard EN 149 approved respirator if exposure limits are exceeded or if irritation or other symptoms are experienced.

Section 9 - PHYSICAL AND CHEMICAL PROPERTIES
?
Physical State: Viscous liquid
Color: clear colorless to yellow - brown
Odor: Not available.
pH: Not available.
Vapor Pressure: Not available.
Viscosity: Not available.
Boiling Point: 72 - 75 deg C @ .20
Freezing/Melting Point: Not available.
Autoignition Temperature: Not applicable.
Flash Point: > 110 deg C (> 230.00 deg F)
Explosion Limits, lower: Not available.
Explosion Limits, upper: Not available.
Decomposition Temperature:
Solubility in water:
Specific Gravity/Density: 1.7710g/cm3
Molecular Formula: C3H7BrO2
Molecular Weight: 154.99

Section 10 - STABILITY AND REACTIVITY
? Chemical Stability:
Stable at room temperature in closed containers under normal storage and handling conditions.
Conditions to Avoid:
Incompatible materials, excess heat, strong oxidants.
Incompatibilities with Other Materials:
Oxidizing agents, acid anhydrides, acid chlorides.
Hazardous Decomposition Products:
Carbon monoxide, irritating and toxic fumes and gases, carbon dioxide, hydrogen bromide.
Hazardous Polymerization: Has not been reported.

Section 11 - TOXICOLOGICAL INFORMATION
? RTECS#:
CAS# 4704-77-2: TY3360000 LD50/LC50:
Not available.
Carcinogenicity:
3-Bromo-1,2-Propanediol - Not listed by ACGIH, IARC, or NTP.
Other:
See actual entry in RTECS for complete information.

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
Not regulated as a hazardous material.
IMO
Not regulated as a hazardous material.
RID/ADR
Not regulated as a hazardous material.

Section 15 - REGULATORY INFORMATION
?
European/International Regulations
European Labeling in Accordance with EC Directives
Hazard Symbols: XI
Risk Phrases:
R 36/37/38 Irritating to eyes, respiratory system
and skin.
Safety Phrases:
S 26 In case of contact with eyes, rinse immediately
with plenty of water and seek medical advice.
S 37/39 Wear suitable gloves and eye/face
protection.
WGK (Water Danger/Protection)
CAS# 4704-77-2: No information available.
Canada
None of the chemicals in this product are listed on the DSL/NDSL list.
CAS# 4704-77-2 is not listed on Canada's Ingredient Disclosure List.
US FEDERAL
TSCA
CAS# 4704-77-2 is not listed on the TSCA inventory.
It is for research and development use only.


SECTION 16 - ADDITIONAL INFORMATION
N/A