4-Chloro-3,5-Dimethylphenol 4-氯-3,5-二甲基苯酚

CAS 88-04-0 MFCD00002324

化学结构图

88-04-0
SMILES: Cc1cc(O)cc(C)c1Cl

化学属性

Mol. FormulaC8H9ClO
Mol. Weight156.61
Melting Point114-116°C
Flash Point138°(280°F)
TSCAYes
Boiling Point246°C at 760 mmHg
Solubility0.3 G/L (20 ºC)
Density0.890
Appearance 无色结晶。熔点115-116℃,沸点246℃。20℃时1g能溶于3L水,能溶于1份95%醇,溶于醚、苯、萜烯类、不挥发油类及氢氧化钠液。微有酚的气味,能随水蒸气挥发。在热水中稳定。

别名和识别编码

Chemical Name4-Chloro-3,5-Dimethylphenol
CAS Number88-04-0
Synonym Chloroxylenol {LY} Chloroxylenol {} {LY} Chloroxylenol {} {} {LY} Chloroxylenol {} {} {} {LY} Chloroxylenol {} {} {} {} {LY} Chloroxylenol {} {} {} {} {} {LY} Chloroxylenol {} {} {} {} {} {} {LY} Chloroxylenol {} {} {} {} {} {} {} {LY} Chloroxylenol {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Chloroxylenol {} {} {} {} {} {} {} {} {} {LY} Chloroxylenol {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {LY} Chloroxylenol {} {} {} {} {} {} {} {} {} {} {} {LY} Chloroxylenol {} {} {} {} {} {} {} {} {} {} {} {} {LY} Chloroxylenol {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Chloroxylenol {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Chloroxylenol {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Chloroxylenol {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Chloroxylenol {} {} {} {} {} {} {} {} {} {} {} {
MDL NumberMFCD00002324
Beilstein Registry Number1862539
EC Number201-793-8
PubChem Substance ID87565335
Merck Number2176
Reaxys-RN1862539
Chemical Name Translation4-氯-3,5-二甲基苯酚
Wiswesser Line NotationQR DG C1 E1
LabNetwork Molecule IDLN00217619
Canonical SMILESOC1=CC(C)=C(Cl)C(C)=C1
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分类

  • Pharmaceuticals
  • {SNA} Building Blocks, C6 to C8, Chemical Synthesis, Organic Building Blocks, Oxygen Compounds, Phenols
  • Aromatics
  • Intermediates & Fine Chemicals
  • {uni_hamburg} no charge; carbocycle; aromatic; 6RingOnly; 6ring; alcohol; 1fragment

产品应用

  • 可用于各种抗菌处理过程,如皮革的抗菌处理、纸的抗菌处理、纺织品的抗菌防霉处理和照片的抗菌防霉处理等。

相关文献及参考

  • Merck: 14,2176 Beilstein:6(2)463
  • Nikolaou, A., et al.: Anal. Bioanal. Chem., 387, 1225 (2007),
  • Short: III/20b
  • Short: EINECS2
  • Heberer, T., et al.: Toxicol. Lett., 131, 5 (2002),
  • Merck: 14,2176
  • Focazio, M., et al.: Sci. Total Environ., 402, 201 (2008),

安全信息

GHS Symbol
WGK Germany1
Precautionary statements
  • 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。
  • P272 Contaminated work clothing should not be allowed out of the workplace. 污染的工作服不得带出工作场所。
  • P273 Avoid release to the environment. 避免释放到环境中。
  • 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。
  • P302+P350
  • P302+P352+P333+P313+P362+P364
  • P305+P351+P338
  • P305+P351+P338+P337+P313
  • P312 Call a POISON CENTER or doctor/physician if you feel unwell. 如果你感觉不适,呼叫解毒中心或医生/医师。
  • P333+P313
  • P337+P313
  • P391 Collect spillage. Hazardous to the aquatic environment 收集对水环境有危害的泄漏物。
  • P501 Dispose of contents/container to..… 处理内容物/容器.....
Hazard statements
  • H302 Harmful if swallowed 吞食有害
  • H303 May be harmfully swallowed 吞食可能有害
  • H315 Causes skin irritation 会刺激皮肤
  • H317 May cause an allergic skin reaction 可能导致皮肤过敏
  • H319 Causes serious eye irritation 严重刺激眼睛
RTECSZE6850000
Personal Protective Equipment dust mask type N95 (US), Eyeshields, Faceshields, Gloves
Signal word Warning
Safety Statements
  • S24 Avoid contact with skin 避免皮肤接触;
  • S37 Wear suitable gloves 戴适当手套;
Risk Statements
  • R22 Harmful if swallowed 吞咽有害
  • R36/38 Irritating to eyes and skin 对眼睛和皮肤有刺激性
  • R43 May cause sensitisation by skin contact 皮肤接触会产生过敏反应
Hazard Codes Xn Xn,Xi
UN Number 3077 UN 3077 9/PG 3
Packing GroupIII
Storage condition 2-8°C {LY} 2-8°C {} {LY} 2-8°C {} {} {LY} 2-8°C {} {} {} {LY} 2-8°C {} {} {} {} {LY} 2-8°C {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {
Hazard Class9
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intraperitoneal
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 115 gm/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
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: 41,595,1952

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : 3830 mg/kg
TOXIC EFFECTS :
   Lungs, Thorax, or Respiration - other changes
   Gastrointestinal - other changes
   Kidney, Ureter, Bladder - other changes
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: 4(5),147,1985

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 1 gm/kg
TOXIC EFFECTS :
   Behavioral - altered sleep time (including change in righting reflex)
   Behavioral - ataxia
   Gastrointestinal - other changes
REFERENCE :
   SRTCAC Science Reports of the Research Institutes, Tohoku University, Series
   C: Medicine. (Tohoku University, Research Institute for Tuberculosis and
   Cancer, 4-1 Seiryo-machi, Sendai, Japan)  V.1-   1949-
   Volume(issue)/page/year: 36(1-4),10,1989

TYPE OF TEST            : Mutation test systems - not otherwise specified
TEST SYSTEM             : Bacteria - Escherichia coli
DOSE/DURATION           : 100 umol/L
REFERENCE :
   MUREAV Mutation Research.  (Elsevier Science Pub. B.V., POB 211, 1000 AE
   Amsterdam, Netherlands) V.1-    1964-  Volume(issue)/page/year: 307,141,1994

TYPE OF TEST            : TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - rat
DOSE                    : 17100 mg/kg
SEX/DURATION            : female 1-19 day(s) after conception
TOXIC EFFECTS :
   Reproductive - Effects on Embryo or Fetus - fetotoxicity (except death,
   e.g., stunted fetus)
   Reproductive - Specific Developmental Abnormalities - musculoskeletal system
REFERENCE :
   AOISDR Annual Report of Osaka City Institute of Public Health and
   Environmental Sciences.  (Osaka- shiritsu Kankyo Kagaku Kenkyusho, 8-34
   Tojo-cho, Tennoji-ku, Osaka 543, Japan) No.42-    1981-
   Volume(issue)/page/year: (45),100,1983

其他信息

  • Sigma Aldrich:88-04-0(sigmaaldrich)
  • Acros Organics:4-氯-3,5-二甲基苯酚 4-Chloro-3,5-dimethylphenol, 99%(88-04-0)
  • 水中溶解度: 0.3 G/L(20° C)。溶于醚,苯,烯醇,烯烃,聚乙二醇和强碱水溶液。
  • 用途一:可用于各种抗菌处理过程,如皮革、纸张的抗菌处理,纺织品、照片的抗菌防霉处理等
  • TCI Shanghai:4-氯-3,5-二甲酚 4-Chloro-3,5-dimethylphenol,>;98.0%(GC)(88-04-0)
  • Hazard Note:Irritant
  • 上游原料:锌粉 --> 二甲酚
  • 用途三:可用于各种抗菌处理过程,如皮革的抗菌处理、纸的抗菌处理、纺织品的抗菌防霉处理和照片的抗菌防霉处理等。
  • MOL 文件:88-04-0.mol
  • Alfa Aesar:4-氯-3,5-二甲基苯酚,98% 4-Chloro-3,5-dimethylphenol, 98+%(88-04-0)
  • 图谱信息:4-氯-3,5-二甲基苯酚(88-04-0)Raman光谱 4-氯-3,5-二甲基苯酚(88-04-0)红外图谱(IR2) 4-氯-3,5-二甲基苯酚(88-04-0)红外图谱(IR1) 4-氯-3,5-二甲基苯酚(88-04-0)质谱(MS) 4-氯-3,5-二甲基苯酚(88-04-0)核磁图( 1 HNMR) 4-氯-3,5-二甲基苯酚(88-04-0)核磁图( 13 CNMR)
  • 海关编码:29081000
  • 用途二:防腐剂、杀菌剂。应用于乳剂、化妆品、油墨、胶合板、塑料中,作为塑料用防霉剂,特别适用于硬质和半硬质聚氯乙烯板材、人造革等。耐热性和耐候性好,水抽出性少,在树脂中的持久性强,一般用量2%。该品低毒。小鼠口服LD50为3450mg/kg。
  • 方法一:由间二甲酚在锌粉存在下直接氯化而得。
  • MSDS 信息:4-Chloro-3,5-dimethylphenol(88-04-0).msds
  • 4-氯-3,5-二甲基苯酚价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2011/08/23 xw090003 4-氯-3,5-二甲基苯酚;4-氯-3,5-二甲酚; 4-氯(对称)间二甲苯酚; 2-氯-5-羟基-1,3-二甲基苯; 2-氯间-5-二甲苯酚; 2-氯-5-羟基间二甲苯 25g 120元 2011/04/16 C0161 4-氯-3,5-二甲酚 4-Chloro-3,5-dimethylphenol 25G 160元 2011/04/16 C0161 4-氯-3,5-二甲酚 4-Chloro-3,5-dimethylphenol 500G 764元

系列性分类