6-Tert-Butyl-2,4-Xylenol 6-叔丁基-2,4-二甲苯酚

CAS 1879-09-0 MFCD00002234

化学结构图

1879-09-0
SMILES: CC1C=C(C(O)=C(C)C=1)C(C)(C)C

化学属性

Mol. FormulaC12H18O
Mol. Weight178.28
Melting Point22 °C
Boiling Point249.0 °C at 760 mmHg
Density0.96
Flash Point111.7 °C
SolubilityInsoluble in water.,
Stability对空气敏感

别名和识别编码

Chemical Name6-Tert-Butyl-2,4-Xylenol
Synonym 2-(tert-Butyl)-4,6-dimethylphenol {LY} 2-(tert-Butyl)-4,6-dimethylphenol {} {LY} 2-(tert-Butyl)-4,6-dimethylphenol {} {} {LY} 2-(tert-Butyl)-4,6-dimethylphenol {} {} {} {LY} 2-(tert-Butyl)-4,6-dimethylphenol {} {} {} {} {LY} 2-(tert-Butyl)-4,6-dimethylphenol {} {} {} {} {} {LY} 2-(tert-Butyl)-4,6-dimethylphenol {} {} {} {} {} {} {LY} 2-(tert-Butyl)-4,6-dimethylphenol {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-(tert-Butyl)-4,6-dimethylphenol {} {} {} {} {} {} {} {} {LY} 2-(tert-Butyl)-4,6-dimethylphenol {} {} {} {} {} {} {} {} {} {LY} 2-(tert-Butyl)-4,6-dimethylphenol {} {} {} {} {} {} {} {} {} {} {LY} 2-(tert-Butyl)-4,6-dimethylphenol {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-(tert-Butyl)-4,6-dimethylphenol {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-(tert-Butyl)-4,6-dimethylphenol {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-(tert-Butyl)-4,6-dimethylphenol {} {} {} {} {} {} {} {} {} {}
MDL NumberMFCD00002234
CAS Number1879-09-0
EC Number217-533-1
Chemical Name Translation6-叔丁基-2,4-二甲苯酚
Reaxys-RN1941702
Beilstein Registry Number6(3)2020
PubChem Substance ID87563872
Wiswesser Line NotationQR B1 D1 F1X1&1&1
LabNetwork Molecule IDLN00223953
Canonical SMILESOC1=C(C)C=C(C)C=C1C(C)(C)C
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分类

  • {uni_hamburg} no charge; carbocycle; aromatic; 6RingOnly; 6ring; alcohol; 1fragment

产品应用

  • A useful phenol for proteomics research

相关文献及参考

  • Short: III/35D2
  • Beilstein:6(3)2020
  • Short: III/38B

安全信息

Hazard Codes Xn
Safety Statements
  • 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；
  • 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；
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
  • 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 RT, stored under nitrogen {LY} RT, stored under nitrogen {} {LY} RT, stored under nitrogen {} {} {LY} RT, stored under nitrogen {} {} {} {LY} RT, stored under nitrogen {} {} {} {} {LY} RT, stored under nitrogen {} {} {} {} {} {LY} RT, stored under nitrogen {} {} {} {} {} {} {LY} RT, stored under nitrogen {} {} {} {} {} {} {} {LY} RT, stored under nitrogen {} {} {} {} {} {} {} {} {LY} RT, stored under nitrogen {} {} {} {} {} {} {} {} {} {LY} RT, stored under nitrogen {} {} {} {} {} {} {} {} {} {} {LY} RT, stored under nitrogen {} {} {} {} {} {} {} {} {} {} {} {LY} RT, stored under nitrogen {} {} {} {} {} {} {} {} {} {} {} {} {LY} RT, stored under nitrogen {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} RT, stored under nitrogen {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} RT, stored under nitrogen {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} RT, stored under nitrogen {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {}
Hazard Class6.1
RTECSZE6825000
GHS Symbol
UN Number 2927 3077 2811
Signal word
Precautionary statements
  • 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
  • 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。
  • 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。
  • P332+P313
  • P501 Dispose of contents/container to..… 处理内容物/容器.....
  • P314 Get medical advice/attention if you feel unwell. 获取医疗咨询/就医，如果你觉得不舒服
  • P301+P312+P330
  • P302+P350
  • P337+P313
  • P302+P352+P332+P313+P362+P364
  • 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。
  • P302+P352+P310+P361+P364
  • P273 Avoid release to the environment. 避免释放到环境中。
  • P305+P351+P338+P337+P313
  • P305+P351+P338
  • 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。
  • P262 Do not get in eyes, on skin, or on clothing. 不要接触眼睛，皮肤或衣服。
Hazard statements
  • H302 Harmful if swallowed 吞食有害
Packing GroupI 
TYPE OF TEST            : LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : 1400 mg/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.  Fo

TYPE OF TEST            : LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - guinea pig
DOSE/DURATION           : 420 mg/kg
TOXIC EFFECTS :
   Behavioral - convulsions or effect on seizure threshold
   Lungs, Thorax, or Respiration - acute pulmonary edema
   Lungs, Thorax, or Respiration - other changes
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: 38,366,1949

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 530 mg/kg
TOXIC EFFECTS :
   Lungs, Thorax, or Respiration - acute pulmonary edema
   Gastrointestinal - ulceration or bleeding from small intestine
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: 38,366,1949

TYPE OF TEST            : LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - rabbit
DOSE/DURATION           : 55 mg/kg
TOXIC EFFECTS :
   Behavioral - convulsions or effect on seizure threshold
   Lungs, Thorax, or Respiration - acute pulmonary edema
   Lungs, Thorax, or Respiration - other changes
REFERENCE :
   JAPMA8 Journal of the American Pharmaceutical Associatio

其他信息

  • 储运特性:库房通风低温干燥
  • 灭火剂:水, 泡沫, 二氧化碳, 干粉
  • TCI Shanghai:6-叔丁基-2,4-二甲苯酚 6-tert-Butyl-2,4-xylenol,>;97.0%(GC)(1879-09-0)
  • 毒性分级:中毒
  • 6-叔丁基-2,4-二甲基苯酚价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2011/08/23 xw010102 2,4-二甲基-6-叔丁基苯酚 100g 450元 2011/04/16 B0903 6-叔丁基-2,4-二甲苯酚 6-tert-Butyl-2,4-xylenol 25G 252元 2011/04/16 B0903 6-叔丁基-2,4-二甲苯酚 6-tert-Butyl-2,4-xylenol 500G 1330元
  • Acros Organics:2-(tert-butyl)-4,6-dimethylphenol(1879-09-0)
  • 用途一:是新型耐高温航空燃料抗氧剂，丙烯酸阻聚剂，同时也是一种非常重要的医药中间体
  • 图谱信息:6-叔丁基-2,4-二甲基苯酚(1879-09-0)核磁图( 13 CNMR) 6-叔丁基-2,4-二甲基苯酚(1879-09-0)红外图谱(IR1) 6-叔丁基-2,4-二甲基苯酚(1879-09-0)质谱(MS)
  • 用途二:TA-24M6B可以作为一种抗氧剂在聚合树脂和航空燃油中使用,同时也可作为医药中间体,并可以在MMA、UV光固单体及树脂、不饱和树脂中作为阻聚剂使用，尤其在高温下，阻聚效果明显。
  • 2-(tert-Butyl)-4,6-dimethylphenol is a useful phenol for proteomics research.
  • 可燃性危险特性:热分解排出辛辣刺激烟雾
  • 类别:有毒物质
  • MSDS 信息:2-(tert-Butyl)-4,6-dimethylphenol(1879-09-0).msds
  • MOL 文件:1879-09-0.mol
  • Hazard Note:Harmful
  • 急性毒性:口服-大鼠 LDL0: 1400 毫克/公斤; 口服-小鼠 LD50: 530 毫克/公斤

系列性分类

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