2-Tert-Butyl-1,4-Benzoquinone 2-叔丁基-1,4-苯醌

CAS 3602-55-9 MFCD00666928

化学结构图

3602-55-9
SMILES: CC(C)(C)C1=CC(=O)C=CC1=O

化学属性

Mol. FormulaC10H12O2
Mol. Weight164.20
Melting Point56.0 to 60.0 deg-C

别名和识别编码

Chemical Name2-Tert-Butyl-1,4-Benzoquinone
MDL NumberMFCD00666928
PubChem Substance ID87564865
CAS Number3602-55-9
EC Number222-757-8
Beilstein Registry Number7(4)2100
Reaxys-RN1860944
Synonym tert-butylquinone 2-叔丁基-1,4-苯醌 TERT.-BUTYL-PARA-QUINONE 2-TERT-BUTYL(1,4)PARAQUINONE 2-tert-Butyl-p-benzoquinone 2-TERT-BUTYL-PARA-QUINONE 2-叔丁基-1,4-苯醌;邻叔丁基对苯醌;特丁基对苯醌 2-TERT-BUTYL-1,4-BENZOQUINONE 2-tert-Butyl-p-quinone 2,5-Cyclohexadiene-1,4-dione,2-(1,1-dimethylethyl)- 2-(1,1-Dimethylethyl)-2,5-cyclohexadien-1,4-dione 2-TERT-BUTYL-1,4-BENZOQUINONE) 98+% tert-butyl-(1,4)benzoquinone 2-(1,1-dimethylethyl)-2,5-cyclohexadien-1,4-dione tert-Butyl-1,4-benzoquinone 2-tert-butyl-p-Benzoquinone 2,5-Cyclohexadien-1,4-dione, 2-(1,1-dimethylethyl)- tert-Butylquinone tert-Butylbenzoquinone 2-tert-Butyl-p-benzoquinone 2-TERT-BUTYLQUINONE tert-Butylquinone 2-TERT-BUTYL-1,4-QUINONE tert-butylbenzoquinone 2-tert-Butyl-1,4-benzoquinone tert-Butylbenzoquinone 2,5-Cyclohexadiene-1,4-dione, 2-(1,1-dimethylethyl)- tert-Butyl-1,4-benzoquinone 叔丁基对苯醌 2-t-Butyl-1,4-benzoquinone 2-tert-Butyl-[1,4]benzoquinone tert-butyl-1,4-benzoquinone p-Benzoquinone, 2-tert-butyl- PARA-BENZOQUINONE,2-TERT-BUTYL- 叔丁对醌 2-tert-Butyl quinone 2-tert-butyl-4-quinone 2-TERT-BUTYL-P-QUINONE 4-dione,2-(1,1-dimethylethyl)-5-cyclohexadien-1 2-tert-butyl-p-benzoquinon 2-(1,1-Dimethylethyl)-1,4-benzoquinone
Chemical Name Translation2-叔丁基-1,4-苯醌
Wiswesser Line NotationL6V DVJ BX1&1&1
LabNetwork Molecule IDLN00237066
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分类

  • {SNA} Building Blocks, C10, Carbonyl Compounds, Chemical Synthesis, Ketones, Organic Building Blocks
  • {uni_hamburg} no charge; carbocycle; aromatic; 6RingOnly; 6ring; ketone; 1fragment
  • Building Blocks, C10, Carbonyl Compounds, Chemical Synthesis, Ketones, Organic Building Blocks

相关文献及参考

  • Short: III/35E Title: Nuclear Magnetic Resonance (NMR) Data: Chemical Shifts for Oxygen-17 Author: Duddeck, H.; Toth, G.; Simon, A. Editor: Gupta, R.R.; Lechner, M.D. Source: Landolt-Börnstein, New Series Volume: III/35E Year: 2002 Keyword: Alipathic and Aromatic hydrocarbons; Coupling constant j; Nuclear Magnetic Resonance; chemical shifts δ ISBN: 3-540-42501-2 ISBN: 978-3-540-42501-4 Internet Resource: DOI:10.1007/b92953 RefComment: VII, 230 pages. With CD-ROM., Hardcover Abstract: This volume provides a comprehensive and evaluated compilation of nuclear magnetic resonance data. Chemical shifts and coupling constants of boron-11 and phosphorus-31 (subvol. A), fluorine-19 and nitrogen-15 (subvol. B), hydrogen-1 (subvol. C), carbon-13 (subvol. D), and oxygen-17 (subvol. E) compounds are tabulated together with the gross- and structure formulas and the most readily available solvents. Due to the large amount of the data merely chemical shifts are presented in the printed versions, and all the data, chemical shifts and coupling constants are provided on CD-ROM's.
  • Short: EINECS Title: EINECS (European Inventory of Existing Commercial Chemical Substances) Source: Official Journal of the European Communities Volume: C 146 A (15.06.1990) Page: 1 Year: 1990 Internet Resource: http://ecb.jrc.ec.europa.eu/esis/index.php?PGM=ein Publish_Date: 1990/06/15

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。
  • 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。
  • P332+P313
  • P305+P351+P338+P337+P313
  • P302+P350
  • 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
  • P337+P313
  • P302+P352+P332+P313+P362+P364
Hazard statements
  • H315 Causes skin irritation 会刺激皮肤
  • H319 Causes serious eye irritation 严重刺激眼睛
  • H335 May cause respiratory irritation 可能导致呼吸道刺激
Hazard Codes Xi
RTECSDK3790000
Personal Protective Equipment dust mask type N95 (US), Eyeshields, Gloves
Signal word Warning
Safety Statements
  • S36 Wear suitable protective clothing 穿戴适当的防护服；
  • 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
TYPE OF TEST            : Mutation in microorganisms
TEST SYSTEM             : Yeast - Saccharomyces cerevisiae
DOSE/DURATION           : 10 mg/L
REFERENCE :
   MUREAV Mutation Research.  (Elsevier Science Pub. B.V., POB 211, 1000 AE
   Amsterdam, Netherlands) V.1-    1964-  Volume(issue)/page/year: 299,9,1993

TYPE OF TEST            : Cytogenetic analysis
TEST SYSTEM             : Rodent - hamster Lung
DOSE/DURATION           : 1500 ug/L
REFERENCE :
   MUREAV Mutation Research.  (Elsevier Science Pub. B.V., POB 211, 1000 AE
   Amsterdam, Netherlands) V.1-    1964-  Volume(issue)/page/year: 241,125,1990

TYPE OF TEST            : Morphological transformation
TEST SYSTEM             : Rodent - mouse Fibroblast
DOSE/DURATION           : 400 ug/L
REFERENCE :
   CRNGDP Carcinogenesis (London). (Oxford Univ. Press, Pinkhill House,
   Southfield Road, Eynsham, Oxford OX8 1JJ, UK)  V.1-    1980-
   Volume(issue)/page/year: 11,1985,1990

TYPE OF TEST            : Gene conversion and mitotic recombination
TEST SYSTEM             : Yeast - Saccharomyces cerevisiae
DOSE/DURATION           : 20 mg/L
REFERENCE :
   MUREAV Mutation Research.  (Elsevier Science Pub. B.V., POB 211, 1000 AE
   Amsterdam, Netherlands) V.1-    1964-  Volume(issue)/page/year: 299,9,1993

TYPE OF TEST            : Mutation in microorganisms
TEST SYSTEM             : Bacteria - Salmonella typhimurium
DOSE/DURATION           : 50 ug/plate
REFERENCE :
   MUREAV Mutation Research.  (Elsevier Science Pub. B.V., POB 211, 1000 AE
   Amsterdam, Netherlands) V.1-    1964-  Volume(issue)/page/year: 176,179,1987

TYPE OF TEST            : DNA repair
TEST SYSTEM             : Bacteria - Bacillus subtilis
DOSE/DURATION           : 50 uL/plate
REFERENCE :
   JNSVA5 Journal of Nutritional Science and Vitaminology.  (Business Center
   for Academic Soc. Japan, 2-4-16 Yayoi, Bunkyo-ku, Tokyo 113, Japan)  V.19-

其他信息

  • MOL 文件:3602-55-9.mol
  • TCI Shanghai:2-叔丁基-1,4-苯醌 2-tert-Butyl-1,4-benzoquinone,>;98.0%(GC)(3602-55-9)
  • 图谱信息:叔丁基对苯醌(3602-55-9)质谱(MS) 叔丁基对苯醌(3602-55-9)核磁图( 1 HNMR) 叔丁基对苯醌(3602-55-9)核磁图( 13 CNMR)
  • Sigma Aldrich:3602-55-9(sigmaaldrich)

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. Carbonyl Compounds 羰基化合物
  5. Ketones - Carbonyl Compounds
  6. C10 - Ketones
  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Chemicals by Class 化学分类法
  4. Benzoquinones

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