2,3,5,6-Tetrachlorophenol 2,3,5,6-四氯苯酚
CAS 935-95-5 MFCD00044671
化学结构图
SMILES: OC1=C(Cl)C(Cl)=CC(Cl)=C1Cl
化学属性
| Mol. Formula | C6H2Cl4O |
|---|---|
| Mol. Weight | 231.89 |
| Flash Point | 11 °C |
| Solubility | 微溶于水，易溶于醇、醚、苯。 |
| Density | 1.709 |
| Boiling Point | 331.59 °C at 760 mmHg |
| Melting Point | 115-116 °C |
别名和识别编码
| Chemical Name | 2,3,5,6-Tetrachlorophenol |
|---|---|
| MDL Number | MFCD00044671 |
| PubChem Substance ID | 24862488 |
| Beilstein Registry Number | 2049586 |
| CAS Number | 935-95-5 |
| EC Number | 213-310-8 |
| Synonym | 2,3,5,6-Tetrachlorophenol {LY} 2,3,5,6-Tetrachlorophenol {} {LY} 2,3,5,6-Tetrachlorophenol {} {} {LY} 2,3,5,6-Tetrachlorophenol {} {} {} {LY} 2,3,5,6-Tetrachlorophenol {} {} {} {} {LY} 2,3,5,6-Tetrachlorophenol {} {} {} {} {} {LY} 2,3,5,6-Tetrachlorophenol {} {} {} {} {} {} {LY} 2,3,5,6-Tetrachlorophenol {} {} {} {} {} {} {} {LY} 2,3,5,6-Tetrachlorophenol {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {LY} 2,3,5,6-Tetrachlorophenol {} {} {} {} {} {} {} {} {} {LY} 2,3,5,6-Tetrachlorophenol {} {} {} {} {} {} {} {} {} {} {LY} 2,3,5,6-Tetrachlorophenol {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {LY} 2,3,5,6-Tetrachlorophenol {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2,3,5,6-Tetrachlorophenol {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2,3,5,6-Tetrachlorophenol {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2,3,5,6-Tetrachlorophenol {} {} {} {} {} {} {} {} {} {} |
| Chemical Name Translation | 2,3,5,6-四氯苯酚 |
| Wiswesser Line Notation | QR BG CG EG FG |
| Canonical SMILES | C1=C(C(=C(C(=C1Cl)Cl)O)Cl)Cl |
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分类
- Alpha sort, Alphabetic, Analytical Standards, Analytical/Chromatography, Chromatography, Environmental Standards, Pesticides & Metabolites, Q-Z, T, TA - TE
- {SNA} All alphabetically sorted, Alphabetical Index of Analytical Standards, Analytical Standards, Analytical/Chromatography, Chromatography, Environmental Standards, Pesticides & Metabolites, Q-Z, T, TA - TE
- {SNA} Alphabetical Index of Analytical Standards, Analytical Standards, Analytical/Chromatography, Chromatography, Environmental Standards, Q-
相关文献及参考
- Short: III/20a Title: Nuclear Quadrupole Resonance Spectroscopy Data: Nuclei D ... Cl Author: Chihara, H.; Nakamura, N. Editor: Hellwege, K.-H.; Hellwege, A.M. Source: Landolt-Börnstein, New Series Volume: III/20a Year: 1988 Keyword: NQR ISBN: 3-540-18161-X ISBN: 978-3-540-18161-3 Internet Resource: DOI:10.1007/b31153 RefComment: IX,677 pages. Hardcover Abstract: Nuclear Quadrupole Resonance Spectroscopy has become a standard method for structural research in molecular and solid state physics as well as for different branches of chemistry. The volumes cover data for more than 8,000 substances in the solid state. Data for free molecules have been published in volumes II/14 and II/15 of the New Series. The tables are arranged according to the atomic number of the elements.
- Short: III/35D2 Title: Nuclear Magnetic Resonance (NMR) Data: Chemical Shifts for Carbon-13, Part 2: Aromatic Compounds Author: Mikhova, B. Editor: Gupta, R.R.; Lechner, M.D. Source: Landolt-Börnstein, New Series Volume: III/35D2 Year: 2005 Keyword: aromatic compounds; carbon-13; chemical shift; coupling constant; molecular structure ISBN: 978-3-540-20189-2 ISBN: 3-540-20189-0 Internet Resource: DOI:10.1007/b83345 RefComment: VIII, 291 p., Hardcover RefComment: Written for Science and engineers in the fields of physics, chemistry and physical chemistry who inted to use NMR to study the structure and the binding of molecules Abstract: Nuclear Magnetic Resonance (NMR) is based on the fact that certain nuclei exhibit a magnetic moment, orient by a magnetic field, and absorb characteristic frequencies in the radiofrequency part of the spectrum. The spectral lines of the nuclei are highly influenced by the chemical environment i.e. the structure and interaction of the molecules. NMR is now the leading technique and a powerful tool for the investigation of the structure and interaction of molecules. The present Landolt-Börnstein volume III/35 Nuclear Magnetic Resonance (NMR)
安全信息
GHS Symbol
- P301+P310
- P261 Avoid breathing dust/fume/gas/mist/vapours/spray. 避免吸入粉尘/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。
- P305+P351+P338
- H315 Causes skin irritation 会刺激皮肤
- H318 Causes serious eye damage 严重伤害眼睛
- H301 Toxic if swallowed 吞食有毒
- H335 May cause respiratory irritation 可能导致呼吸道刺激
- S39 Wear eye/face protection 戴眼睛/面孔保护装置；
- S36/37 Wear suitable protective clothing and gloves 穿戴适当的防护服和手套；
- 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；
- S16 Keep away from sources of ignition - No smoking 远离火源，禁止吸烟；
- 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）；
- R11 Highly flammable 非常易燃
- R23/24/25 Toxic by inhalation, in contact with skin and if swallowed 吸入，皮肤接触及吞食都有毒
- R39/23/24/25 Toxic: danger of very serious irreversible effects through inhalation, in contact with skin and if swallowed 毒性：吸入，皮肤接触和吞食都会产生十分严重的不可逆危险
- R37/38 Irritating to respiratory system and skin 对呼吸系统和皮肤有刺激性
- R41 Risk of serious damage to eyes 有严重损伤眼睛的危险
- R25 Toxic if swallowed 吞咽有毒
TYPE OF TEST : LD50 - Lethal dose, 50 percent kill ROUTE OF EXPOSURE : Oral SPECIES OBSERVED : Rodent - mouse DOSE/DURATION : 109 mg/kg TOXIC EFFECTS : Details of toxic effects not reported other than lethal dose value REFERENCE : ARTODN Archives of Toxicology. (Springer-Verlag, Heidelberger Pl. 3, D-1000 Berlin 33, Fed. Rep. Ger.) V.32- 1974- Volume(issue)/page/year: 40,63,1978
TYPE OF TEST : LD50 - Lethal dose, 50 percent kill ROUTE OF EXPOSURE : Oral SPECIES OBSERVED : Rodent - gerbil DOSE/DURATION : 979 mg/kg TOXIC EFFECTS : Details of toxic effects not reported other than lethal dose value REFERENCE : ARTODN Archives of Toxicology. (Springer-Verlag, Heidelberger Pl. 3, D-1000 Berlin 33, Fed. Rep. Ger.) V.32- 1974- Volume(issue)/page/year: 40,63,1978
TYPE OF TEST : LD50 - Lethal dose, 50 percent kill ROUTE OF EXPOSURE : Intraperitoneal SPECIES OBSERVED : Rodent - mouse DOSE/DURATION : 48 mg/kg TOXIC EFFECTS : Details of toxic effects not reported other than lethal dose value REFERENCE : ARTODN Archives of Toxicology. (Springer-Verlag, Heidelberger Pl. 3, D-1000 Berlin 33, Fed. Rep. Ger.) V.32- 1974- Volume(issue)/page/year: 40,63,1978
TYPE OF TEST : LDLo - Lowest published lethal dose ROUTE OF EXPOSURE : Administration onto the skin SPECIES OBSERVED : Rodent - rat DOSE/DURATION : 2 gm/kg TOXIC EFFECTS : Behavioral - somnolence (general depressed activity) Behavioral - convulsions or effect on seizure threshold Behavioral - muscle weakness REFERENCE : BECTA6 Bulletin of Environmental Contamination and Toxicology. (Springer-Verlag New York, Inc., Service Center, 44 Hartz Way, Secaucus, NJ 07094) V.1- 1966- Volume(issue)/page/year: 31,680,1983
TYPE OF TEST : Cytogenetic analysis TEST SYSTEM : Rodent - hamster Lung DOSE/DURATION : 60 mg/L REFERENCE : MUREAV Mutation Research. (Elsevier Science Pub. B.V., POB 211, 1000 AE Amsterdam, Netherlands) V.1- 1964- Volume(issue)/page/year: 241,175,1990
其他信息
- 外观性质:灰白色至褐色粉末。
- MSDS 信息:2,3,5,6-四氯苯酚(935-95-5).msds
- Sigma Aldrich:935-95-5(sigmaaldrich)
- 图谱信息:2,3,5,6-四氯酚(935-95-5)核磁图( 1 HNMR) 2,3,5,6-四氯酚(935-95-5)红外图谱(IR1) 2,3,5,6-四氯酚(935-95-5)核磁图( 13 CNMR) 2,3,5,6-四氯酚(935-95-5)红外图谱(IR2) 2,3,5,6-四氯酚(935-95-5)质谱(MS)
- MOL 文件:935-95-5.mol
- 易溶于乙醇、乙醚、苯，极微溶于水。有毒。有刺激性
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