3-Chlorophenol 间氯苯酚

CAS 108-43-0 MFCD00002256

化学结构图

108-43-0
SMILES: Oc1cccc(Cl)c1

化学属性

Mol. FormulaC6H5ClO
Mol. Weight128.56
Refractive indexn20/D 1.563(lit.)
Boiling Point-
Density1.218 g/mL at 25 °C(lit.)
Melting Point31-34 °C(lit.)
Flash Point>110°C
TSCAYes
Solubility微溶于水,溶于醇、醚、碱液。
Stability对光敏感

别名和识别编码

Chemical Name3-Chlorophenol
CAS Number108-43-0
Synonym 3-Chlorophenol {LY} 3-Chlorophenol Chlorophenol (meta-) M-CHLOROPHENOL MONOCHLOROPH {} {LY} 3-Chlorophenol {} {} {LY} 3-Chlorophenol {} {} {} {LY} 3-Chlorophenol {} {} {} {} {LY} 3-Chlorophenol {} {} {} {} {} {LY} 3-Chlorophenol {} {} {} {} {} {} {LY} 3-Chlorophenol {} {} {} {} {} {} {} {LY} 3-Chlorophenol {} {} {} {} {} {} {} {} {LY} 3-Chlorophenol {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 3-Chlorophenol {} {} {} {} {} {} {} {} {} {} {LY} 3-Chlorophenol {} {} {} {} {} {} {} {} {} {} {} {LY} 3-Chlorophenol {} {} {} {} {} {} {} {} {} {} {} {} {LY} 3-Chlorophenol {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 3-Chlorophenol {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 3-Chlorophenol {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 3-Chlorophenol {} {} {} {} {} {} {
PubChem Substance ID87565403
EC Number203-582-6
Beilstein Registry Number6,185
MDL Number-
Reaxys-RN1634401
Merck Number2154
Chemical Name Translation间氯苯酚
Wiswesser Line NotationQR CG
LabNetwork Molecule IDLN00194307
InChIInChI=1S/C6H5ClO/c7-5-2-1-3-6(8)4-5/h1-4,8H
Canonical SMILESOC1=CC=CC(Cl)=C1
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分类

  • Bioactive Small Molecules, Building Blocks, C-CH, C6 to C8, Cell Biology, Chemical Synthesis, Organic Building Blocks, Oxygen Compounds, Phenols
  • {SNA} All alphabetically sorted, Alphabetical Index of Analytical Standards, Analytical Standards, Analytical/Chromatography, Bioactive Small Molecules, C, C-CH, CH, Cell Biology, Chromatography, Environmental Standards, Pesticides & Metabolites
  • {SNA} Building Blocks, C6 to C8, Chemical Synthesis, Organic Building Blocks, Oxygen Compounds,

产品应用

  • 本品可用于有机合成, 间氯苯酚还用于显微分析。

相关文献及参考

  • Short: II/27B
  • Merck:14,2154
  • Gershon, H. et al.: Monatsh. Chem., 126, 1161 (1995); Dranca, I.: Environ. Eng. Man. J., 5, 203 (2006);
  • Short: III/20b
  • Merck:14,2154 Beilstein:6,185

安全信息

GHS Symbol
WGK Germany2
Hazard statements
  • H315 Causes skin irritation 会刺激皮肤
  • H411 Toxictoaquaticlifewithlonglastingeffects 对水生生物有毒性并具有长期影响。
  • H318 Causes serious eye damage 严重伤害眼睛
  • H302+H312+H332
  • H332 Harmful if inhaled 吸入有害
  • H302 Harmful if swallowed 吞食有害
  • H312 Harmful in contact with skin 皮肤接触有害
Personal Protective Equipment dust mask type N95 (US), Eyeshields, Gloves
Hazard Codes Xn;N Xn,N
RTECSSK2450000
Precautionary statements
  • P260 Do not breathe dust/fume/gas/mist/vapours/spray. 不要吸入粉尘/烟/气体/烟雾/蒸汽/喷雾。
  • P261 Avoid breathing dust/fume/gas/mist/vapours/spray. 避免吸入粉尘/烟/气体/烟雾/蒸汽/喷雾。
  • P305+P351+P338
  • P332+P313
  • P501 Dispose of contents/container to..… 处理内容物/容器.....
  • P301+P312+P330
  • P302+P350
  • P337+P313
  • P280 Wear protective gloves/protective clothing/eye protection/face protection. 戴防护手套/防护服/眼睛的保护物/面部保护物。
  • P271 Use only outdoors or in a well-ventilated area.? 只能在室外或通风良好的地方使用。
  • P305+P351+P338+P310
  • P302+P352+P312+P362+P364
  • P270 Do not eat, drink or smoke when using this product. 使用本产品时不要吃东西,喝水或吸烟。
  • P264 Wash hands thoroughly after handling. 处理后要彻底洗净双手。
  • P304+P340+P312
  • P273 Avoid release to the environment. 避免释放到环境中。
  • P305+P351+P338+P337+P313
  • P308+P311
  • P405 Store locked up. 上锁保管。
  • P391 Collect spillage. Hazardous to the aquatic environment 收集对水环境有危害的泄漏物。
  • P202 Do not handle until all safety precautions have been read and understood. 已阅读并理解所有的安全预防措施之前,切勿操作。
  • P201 Obtain special instructions before use. 使用前获取专门指示。
Signal word Danger Warning {} {} {} {} {} {} {TCI}
Safety Statements
  • S61 Avoid release to the environment. Refer to special instructions/safety data sheet 避免释放到环境中,参考特别指示/安全收据说明书;
  • S28 After contact with skin, wash immediately with plenty of ... (to be specified by the manufacturer) 皮肤接触后,立即用大量…(由生产厂家指定)冲洗;
  • S26 In case of contact with eyes, rinse immediately with plenty of water and seek medical advice 眼睛接触后,立即用大量水冲洗并征求医生意见;
  • S36/37/39 Wear suitable protective clothing, gloves and eye/face protection 穿戴适当的防护服、手套和眼睛/面保护;
Risk Statements
  • R51/53
  • R20/21/22 Harmful by inhalation, in contact with skin and if swallowed 吸入、皮肤接触和不慎吞咽有害
  • R36/37/38 Irritating to eyes, respiratory system and skin 对眼睛、呼吸系统和皮肤有刺激性
UN Number 2020 UN 2020 6.1/PG 3 UN2020
Packing GroupIII
Storage condition Store at room temperature {LY} Store at room temperature {} {LY} Store at room temperature {} {} {LY} Store at room temperature {} {} {} {LY} Store at room temperature {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Store at room temperature {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {}
Hazard Class6.1
Warnings 危化品目录(2015)
TYPE OF TEST            : TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE       : Administration onto the skin
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 6000 mg/kg/15W-I
TOXIC EFFECTS :
   Tumorigenic - equivocal tumorigenic agent by RTECS criteria
   Skin and Appendages - tumors
REFERENCE :
   CNREA8 Cancer Research. (Public Ledger Building, Suit 816, 6th & Chestnut
   Sts., Philadelphia, PA 19106)  V.1-    1941-  Volume(issue)/page/year:
   19,413,1959

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 521 mg/kg
TOXIC EFFECTS :
   Behavioral - tremor
   Behavioral - convulsions or effect on seizure threshold
   Lungs, Thorax, or Respiration - respiratory stimulation
REFERENCE :
   TOLED5 Toxicology Letters.  (Elsevier Science Pub. B.V., POB 211, 1000 AE
   Amsterdam, Netherlands) V.1-    1977-  Volume(issue)/page/year: 29,39,1985

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intraperitoneal
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : 355 mg/kg
TOXIC EFFECTS :
   Behavioral - tremor
   Behavioral - convulsions or effect on seizure threshold
   Nutritional and Gross Metabolic - body temperature increase
REFERENCE :
   BJPCAL British Journal of Pharmacology and Chemotherapy.  (London, UK)
   V.1-33, 1946-68.  For publisher information, see BJPCBM.
   Volume(issue)/page/year: 13,20,1958

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : 570 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   FEPRA7 Federation Proceedings, Federation of American Societies for
   Experimental Biology. (Bethesda, MD)  V.1-46, 1942-87.
   Volume(issue)/page/year: 2,76,1943

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Subcutaneous
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : 1390 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   FEPRA7 Federation Proceedings, Federation of American Societies for
   Experimental Biology. (Bethesda, MD)  V.1-46, 1942-87.
   Volume(issue)/page/year: 2,76,1943

TYPE OF TEST            : Mutation in microorganisms
TEST SYSTEM             : Bacteria - Salmonella typhimurium
DOSE/DURATION           : 10 ug/plate
REFERENCE :
   TECSDY Toxicological and Environmental Chemistry.  (Gordon & Breach Science
   Pub. Inc., 1 Park Ave., New York, NY 10016)  V.3(3/4)-    1981-
   Volume(issue)/page/year: 14,143,1987

Restrict 危险品

其他信息

  • 在空气中变色。溶于乙醇、乙醚和苛性碱溶液,微溶于冷水。低毒,半数致死量(大鼠,经口)570mg/kg。有腐蚀性。
  • TCI Shanghai:3-氯苯酚 3-Chlorophenol,>;98.0%(GC)(108-43-0)
  • Alfa Aesar:3-氯苯酚,98+% 3-Chlorophenol, 98+%(108-43-0)
  • {
  • 检测方法:GC
  • {Chemical
  • 图谱信息:3-氯苯酚(108-43-0)核磁图( 1 HNMR) 3-氯苯酚(108-43-0)核磁图( 13 CNMR) 3-氯苯酚(108-43-0)质谱(MS) 3-氯苯酚(108-43-0)
  • 所属类别二:农药中间体: 杀菌剂中间体: 三唑类杀菌剂
  • 用途四:间氯苯酚是植物生长调节剂调果酸的中间体。
  • MOL 文件:108-43-0.mol
  • 3-氯苯酚价格(试剂级):更新日期 产品编号 产品名
  • 可燃性危险特性:
  • 用途五:该品可用于有机合成,其异构体邻氯苯酚和对氯苯酚在农药、染料、医药工业上占有重要地位,用它替代邻氯苯酚或对氯苯酚可以开发出性能优异的农药、医
  • 用途一:用于制药、染料工业及有机合成,也用作消毒剂
  • 毒性分级:中毒
  • Acros Organics:3-氯苯酚 3-Chlorophenol, 99%(108-43-0)
  • 类别:有毒物品
  • 用途六:本品可用于有机合成, 间氯苯酚还用于显微分析。
  • 所属类别一:农药中间体: 植物生长调节剂中间体
  • 下游产品:4-氯-2-羟基苯甲醛 --> 6-氯水杨醛 --> 3-氯苯氧基乙酰基氯
  • 用途三:对氯苯酚又称4-氯苯酚,是重要的医药、农药和染料中间体,在农药上可用以合成三唑酮、三唑醇、萘乙酸(对氯苯氧乙酸)、丙虫磷、毒鼠磷、杀螟腈、苯腈磷、杀螨脒、螨卵酯、除螨酯、咪菌酮等品种。
  • 方法一:其制备方法是由苯酚直接氯化,氯化剂为次氯酸钠,得到间氯苯酚、对氯苯酚和邻氯苯酚,进行分离而得到间氯苯酚。 也可以用间氯苯胺重氮化,可以得到纯度较高的间氯苯酚。
  • 方法二:其制备方法有以下三种。 二氯硫酰作为氯化剂使苯酚氯化 将苯酚加热熔融后,温度降到40℃,慢慢加入二氯硫酰,约需40~50h,边搅拌边滴加二氯硫酰,待二氯硫酰加完后,再升温至30~40℃保温数小时,冷至室温,用水洗涤,再用碳酸钠洗涤和水洗涤得到的邻位和对位产品,然后减压蒸馏,分离,冷却结晶得到产品。 对氯苯胺重氮化 将对氯苯胺加入到反应器中,加入水、亚硝酸钠和硫酸,在0℃左右进行重氮化得到重氮盐,然后将重氮盐进行水解即得产品。 用氯气直接氯化 将苯酚加热熔融后加入铁粉等催化剂,控制一定的温度通入氯气,通入的氯气量要控制,通氯气结束后再保温数小时,冷却进行洗涤等后处理,然后再在减压下进行蒸馏,分离邻氯苯酚和对氯苯酚,冷却得到产品。 综上所述,3种方法中对氯苯胺重氮化法由于工艺复杂,成本较高,且废水较多,工业上已很少使用;二氯硫酰法在铁催化剂存在下进行氯化反应时间长,生产能力低,用二氯硫酰成本较高,但该方法对位异构体产率较高,达70%~75%,目前还有不少工厂采用此法;最近我国用氯气直接氯化法工艺流程简单,无须溶剂,投资少,同时成本较低,是一条经济合理的工艺路线,但该法生产对氯苯酚对设备腐蚀严重。
  • 3-氯苯酚价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2014/06/02 C0242 3-氯苯酚 3-Chlorophenol 25G 366元 2014/06/02 C0242 3-氯苯酚 3-Chlorophenol 500G 3400元 2010/06/21 109810050 3-氯苯酚 3-Chlorophenol 99% 5 GR 16
  • F:9
  • 用途七:用作有机合成中间体。用于ICP-AES、AAS、AFS、ICP-MS、离子色谱等。滴定分析用标准溶液。
  • 方法三:由间氯苯胺用通常方法重

系列性分类


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