4-Chlorobenzene-1,3-diol 4-氯间苯二酚

CAS 95-88-5 MFCD00002273

化学结构图

95-88-5
SMILES: Oc1ccc(Cl)c(O)c1

化学属性

Mol. FormulaC6
Mol. Weight145
Boiling Point256°C(lit.)
Melting Point105.0 to 110.0 deg-C
Density1.422
TSCAYes
Solubility可溶
Flash Point146-148°C/18mm
Appearance 无色结晶。熔点89℃（106.5-107.5℃），沸点259℃，147℃（2.4kPa）。溶于水、醇、醚、苯和二硫化碳。能升华。与氯化铁作用生成蓝紫色。
Stability空气敏感，光敏感

别名和识别编码

Chemical Name4-Chlorobenzene-1,3-diol
Synonym 1,3-Benzenediol, 4-chloro- 1 1,3-二羟基-4-氯苯; 2,4-Dihydroxychlorobenzene 1,3-BENZENEDIOL, 4-CHLORO- 4-氯苯酚 4-氯雷琐辛(CI 76510) 4-氯间苯二酚 2,4-dihydroxychlorobenzene 4-Chlororesorcinol,98% 3-二羟基苯 4-氯-1,3-苯二酚 4-CHLOROESORCINOL 4-CHLORO-1,3-BENZENEDIOL 6-chlororesorcinol 1-氯-2,4-二羟基苯 4-CHLORORESORCINOL 1-Chloro-2,4-dihydroxybenzene 1-氯-2 1-CHLORO-2,4-DIHYDROXYBENZENE Resorcinol, 4-chloro- C.I. 76510 1,3-二羟基-4-氯苯 p-Chlororesorcinol CHLORORESORCINOL(4-) 1-Chloro-2,4-dihydroxybenzene, 1,3-Dihydroxy-4-chlorobenzene
MDL NumberMFCD00002273
PubChem Substance ID87565439
CAS Number95-88-5
EC Number202-462-0
Beilstein Registry Number6(2)818
Reaxys-RN2042864
Chemical Name Translation4-氯间苯二酚
Wiswesser Line NotationQR CQ DG
LabNetwork Molecule IDLN00225041
InChIInChI=1S/C6H5ClO2/c7-5-2-1-4(8)3-6(5)9/h1-3,8-9H
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分类

  • Building Blocks, Chemical Synthesis, Organic Building Blocks, Oxygen Compounds, Polyols
  • {SNA} Building Blocks, Chemical Synthesis, Organic Building Blocks, Oxygen Compounds, Polyols

相关文献及参考

  • Beil. 6 ,II,818
  • Aldrich MSDS 1 , 455:D / Corp MSDS 1 (1), 854:D / FT-IR 2 (2), 1889:C / FT-IR 1 (1), 1105:C / FT-NMR 1 (2), 301:C / IR-Spectra (3), 665:B / IR-Spectra (2), 593:E / NMR-Reference 2 (1), 901:B / RegBook 1 (1), 1297:I / Sax 6 , 774 / Sigma FT-IR 1 (2), 394:D / Structure Index 1 , 198:A:4 / Vapor Phase 3 , 1040:C

安全信息

WGK Germany3
GHS Symbol
Precautionary statements
  • 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。
  • P305+P351+P338+P337+P313
  • P362 Take off contaminated clothing and wash before reuse. 脱掉污染的衣服，清洗后方可重新使用
  • P264 Wash hands thoroughly after handling. 处理后要彻底洗净双手。
  • P501 Dispose of contents/container to..… 处理内容物/容器.....
  • 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
  • P302+P352+P332+P313+P362+P364
  • P301+P312+P330
  • 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。
  • P337+P313
Hazard statements
  • H315 Causes skin irritation 会刺激皮肤
  • H335 May cause respiratory irritation 可能导致呼吸道刺激
  • H319 Causes serious eye irritation 严重刺激眼睛
  • H302+H312+H332
  • H302 Harmful if swallowed 吞食有害
  • H332 Harmful if inhaled 吸入有害
  • H312 Harmful in contact with skin 皮肤接触有害
Hazard Codes Xn
RTECSVH0450000
Personal Protective Equipment dust mask type N95 (US), Eyeshields, Faceshields, Gloves
Signal word
Safety Statements
  • 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 Wear suitable protective clothing 穿戴适当的防护服；
  • 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
  • R36/37/38 Irritating to eyes, respiratory system and skin 对眼睛、呼吸系统和皮肤有刺激性
  • R22 Harmful if swallowed 吞咽有害
  • 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
Storage condition 充氩保存 
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intraperitoneal
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 195 mg/kg
TOXIC EFFECTS :
   Behavioral - somnolence (general depressed activity)
   Behavioral - tremor
   Behavioral - ataxia
REFERENCE :
   JAPMA8 Journal of the American Pharmaceutical Association, Scientific
   Edition.  (Washington, DC) V.29-49, 1940-60.  For publisher information, see
   JPMSAE.  Volume(issue)/page/year: 46,185,1957

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : 369 mg/kg
TOXIC EFFECTS :
   Behavioral - somnolence (general depressed activity)
   Behavioral - ataxia
   Skin and Appendages - hair
REFERENCE :
   FCTXAV Food and Cosmetics Toxicology.  (London, UK)  V.1-19, 1963-81.  For
   publisher information, see FCTOD7.  Volume(issue)/page/year: 15,607,1977

TYPE OF TEST            : TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - rat
DOSE                    : 2 gm/kg
SEX/DURATION            : female 6-15 day(s) after conception
TOXIC EFFECTS :
   Reproductive - Fertility - post-implantation mortality (e.g. dead and/or
   resorbed implants per total number of implants)
REFERENCE :
   JACTDZ Journal of the American College of Toxicology.  (Mary Ann Liebert,
   Inc., 1651 Third Ave., New York, NY 10128)  V.1-12, 1982-1993. Discontinued.
    Volume(issue)/page/year: 2(4),325,1983

其他信息

  • MOL 文件:95-88-5.mol
  • 方法一:由间苯二酚与二氯硫酰反应而得。将间苯二酚和乙醚混合，搅拌加热回流，慢慢滴加二氯硫酰。再升温至60℃保温1h。回收乙醚后常压蒸馏，将蒸馏液再进行减压蒸馏，收集131℃（0.8-0.93kPa）或160-164℃（4.0kPa）馏分即得成品。
  • 4-氯间苯二酚价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2014/06/02 C0285 4-氯间苯二酚 4-Chlororesorcinol 500G 1820元 2014/06/02 C0285 4-氯间苯二酚 4-Chlororesorcinol 25G 228元 2010/06/21 110065000 4-氯间苯二酚 4-Chlororesorcinol 98% 500 GR 1342元
  • TCI Shanghai:4-氯间苯二酚 4-Chlororesorcinol,>;95.0%(GC)(95-88-5)
  • Acros Organics:4-氯间苯二酚 4-Chlororesorcinol, 98%(95-88-5)
  • 用途一:主要用于有机合成
  • Sigma Aldrich:95-88-5(sigmaaldrich)
  • 海关编码:29081000
  • 用途二:用于有机合成，制取各种醚类衍生物；用于晒图纸；分析试剂。
  • 上游原料:磺酰氯 --> 间苯二酚
  • 图谱信息:4-氯间苯二酚(95-88-5)核磁图( 1 HNMR) 4-氯间苯二酚(95-88-5)红外图谱(IR1) 4-氯间苯二酚(95-88-5)质谱(MS) 4-氯间苯二酚(95-88-5)核磁图( 13 CNMR) 4-氯间苯二酚(95-88-5)红外图谱(IR2)
  • Alfa Aesar:4-氯间苯二酚,98% 4-Chlororesorcinol, 98%(95-88-5)
  • MSDS 信息:4-Chloro-1,3-dihydroxybenzene(95-88-5).msds

系列性分类

  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Organic Building Blocks 有机砌块
  4. Oxygen Compounds 氧化合物
  5. Phenols 酚类
  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Organic Building Blocks 有机砌块
  4. Oxygen Compounds 氧化合物
  5. Protected Alcohols/Phenols - Oxygen Compounds
  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Organic Building Blocks 有机砌块
  4. Oxygen Compounds 氧化合物
  5. Polyols - Oxygen Compounds
  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Organic Building Blocks 有机砌块
  4. Oxygen Compounds 氧化合物
  5. Phenols