4-Chlorothiophenol 4-氯苯硫酚

CAS 106-54-7 MFCD00004847

化学结构图

106-54-7
SMILES: Sc1ccc(Cl)cc1

化学属性

Mol. FormulaC6H5ClS
Mol. Weight144.62
Density1.268
Boiling Point
Melting PointNo Data Available
Flash Point>110°C
Solubility不溶于水,溶于热醇、醚、苯。
TSCAYes
Stability对空气敏感

别名和识别编码

Chemical Name4-Chlorothiophenol
CAS Number106-54-7
EC Number203-408-9
Beilstein Registry Number605971
MDL NumberMFCD00004847
Synonym 4-Chlorothiophenol 4-Chlorothiophenol(4-Chlorobenzenethiol) {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 4-​Chlorothiophenol(4-Chlorobenzenethiol) {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {uni_hamburg} 4-chlorothiophenol {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {Chemicalbook} 4-chloro-benzenethio {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {Chemicalbook} 4-Cyano-Acetophonene/4-CA {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {Chemicalbook} 4-Chlorothiophenol/4-Chlorobenzenethiol {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {}
PubChem Substance ID87565308
Reaxys-RN605971
Chemical Name Translation4-氯苯硫酚
Wiswesser Line NotationSHR DG
LabNetwork Molecule IDLN00224184
InChIInChI=1S/C6H5ClS/c7-5-1-3-6(8)4-2-5/h1-4,8H
Canonical SMILESSC1=CC=C(Cl)C=C1
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分类

  • {SNA} Building Blocks, Chemical Synthesis, Organic Building Blocks, Sulfur Compounds, Thiols/Mercaptans
  • {uni_hamburg} no charge; carbocycle; aromatic; 6RingOnly; 6ring; thiol; 1fragment

相关文献及参考

  • Short: II/27B
  • Short: EINECS
  • Short: IV/6
  • Beilstein:6,326

安全信息

Signal word Danger
GHS Symbol
WGK Germany3
Safety Statements
  • S20 When using do not eat or drink 使用时,不得进食,饮水;
  • 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;
  • S45 In case of accident or if you feel unwell seek medical advice immediately (show the label where possible) 发生事故时或感觉不适时,立即求医(可能时出示标签);
Risk Statements
  • R22 Harmful if swallowed 吞咽有害
  • R34 Causes burns 会导致灼伤
  • R36/37/38 Irritating to eyes, respiratory system and skin 对眼睛、呼吸系统和皮肤有刺激性
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。
  • P264 Wash hands thoroughly after handling. 处理后要彻底洗净双手。
  • 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。
  • 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。
  • P301+P330+P331
  • P301+P330+P331+P310
  • P303+P361+P353+P310+P363
  • P304+P340
  • P304+P340+P310
  • P305+P351+P338
  • P305+P351+P338+P310
  • P310 Immediately call a POISON CENTER or doctor/physician. 立即呼救解毒中心或医生/医师。
  • P405 Store locked up. 上锁保管。
  • P501 Dispose of contents/container to..… 处理内容物/容器.....
Hazard statements
  • H314 Causes severe skin burns and eye damage 导致严重的皮肤灼伤和眼睛损伤
  • H302 Harmful if swallowed 吞食有害
Personal Protective Equipment Eyeshields, Faceshields, full-face particle respirator type N100 (US), Gloves, respirator cartridge type N100 (US), type P1 (EN143) respirator filter, type P3 (EN 143) respirator cartridges
RTECSDC1050000
Hazard Codes 8 C
UN Number 1759 3261
Packing GroupII
Storage condition -20 -20°C -20℃ Store at room temperature {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {
Hazard Class8
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           : 8000 mg/kg/20W-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       : Intraperitoneal
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 75 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   NTIS** National Technical Information Service.  (Springfield, VA 22161)
   Formerly U.S. Clearinghouse for Scientific & Technical Information.
   Volume(issue)/page/year: AD691-490

Restrict 危险品

其他信息

  • Acros Organics:4-氯硫酚 4-Chlorothiophenol, 98%(106-54-7)
  • 敏感性:Stench/Lachrymatory
  • 急性毒性:腹腔- 小鼠 LD50: 75 毫克/ 公斤
  • TCI Shanghai:4-氯苯硫酚 4-Chlorobenzenethiol,>;98.0%(GC)(T)(106-54-7)
  • 图谱信息:4-氯苯硫酚(106-54-7)核磁图( 13 CNMR) 4-氯苯硫酚(106-54-7)核磁图( 1 HNMR) 4-氯苯硫酚(106-54-7)红外图谱(IR1) 4-氯苯硫酚(106-54-7)质谱(MS)
  • 灭火剂:泡沫、干粉、二氧化碳
  • 类别:有毒物品
  • 储运特性:库房通风低温干燥; 与食品原料、酸类、氧化剂分开储运
  • MOL 文件:106-54-7.mol
  • 用途二:农药和医药的中间体,也用于增塑剂、油类添加剂、润湿剂。
  • 下游产品:(5-氯-1-苯并噻吩-3-基)甲胺 --> (5-氯-1-苯并噻吩-3-基)甲醇 --> 3-溴甲基-5-氯苯并噻吩 --> 5-氯苯并[B]噻吩-3-羧酸 --> 5-氯-3-甲基苯并(B)噻吩-2-磺酰胺 --> 5-氯-3-甲基苯并(B)噻吩-2-磺酰氯 --> 5-氯-3-甲基苯并噻吩 --> 2-氯噻吨酮 --> 5-氯苯并噻吩 --> 三硫磷 --> 2-氯-9-[3-(二甲基氨基)丙基]噻吨-9-醇 --> 对氯苯氯甲基硫醚
  • 用途一:用作医药、染料中间体
  • 刺激数据:皮肤-兔 20 毫克/24小时 中度; 眼睛-兔 0.05 毫克/24小时 重度
  • Hazard Note:Corrosive/Lachrymatory/Stench
  • F:9-13-23
  • 上游原料:硫酸 --> 氯磺酸 --> 氯苯
  • Alfa Aesar:对氯苯硫酚,97% 4-Chlorothiophenol, 97%(106-54-7)
  • 4-氯苯硫酚价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2014/06/02 C0129 4-氯苯硫酚 4-Chlorobenzenethiol 25G 208元 2014/06/02 C0129 4-氯苯硫酚 4-Chlorobenzenethiol 500G 1350元 2010/06/21 154761000 4-氯苯硫酚 4-Chlorothiophenol 98% 100 GR 424元
  • 可燃性危险特性:明火可燃; 遇热放出有毒氧化硫、氯化物气体
  • 方法一:氯苯经氯磺化、还原而得。
  • 毒性分级:高毒
  • Sigma Aldrich:106-54-7(sigmaaldrich)
  • 外观性质:具有刺激性恶臭味的白色结晶。
  • MSDS 信息:对氯硫酚(106-54-7).msds

系列性分类


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