4-Nitrophenyl Isothiocyanate 异硫代氰基4-硝基苯酯

CAS 2131-61-5 MFCD00007307

化学结构图

2131-61-5
SMILES: O=[N+]([O-])c1ccc(N=C=S)cc1

化学属性

Mol. FormulaC7H4N2O2S
Mol. Weight180
Boiling Point137-138 °C/11 mmHg(lit.)
Melting Point110.0 to 114.0 deg-C
TSCAYes
Flash Point137-138°C/11mm

别名和识别编码

Chemical Name4-Nitrophenyl Isothiocyanate
Synonym P-NITROPHENYL ISOTHIOCYANATE 1-ISOTHIOCYANATO-4-NITROBENZENE 4-Nitrophenylisothiocyanat 4-硝基苯基异硫氰酸酯 Isothiocyansäure-4-nitrophenylester 4-Nitrophenyl-isothiocyanat 1-isothiocyanato-4-nitro-benzene Benzene, 1-isothiocyanato-4-nitro- 1-Isothiocyanato-4-nitrobenzene 4-Nitrobenzyl-isothiocyanat 4-nitrophenyl isothiocyanate 1-isothiocyanato-4-nitro-benzen 异硫代氰基4-硝基苯酯 p-nitrophenyl isothiocyanate 4-硝苯基异硫氰酸酯 p-Nitrophenylthiocyanat 4-nitrobenzyl-isothiocyanate 4-NITROPHENYL ISOTHIOCYANATE Isothiocyanic Acid 4-Nitrophenyl Ester 4-硝基苯硫代异氰酸酯 4-nitro-phenyl isothiocyanate
MDL NumberMFCD00007307
CAS Number2131-61-5
PubChem Substance ID75044
Beilstein Registry Number12(4)1653
EC Number218-359-9
Reaxys-RN640027
Chemical Name Translation异硫代氰基4-硝基苯酯
InChIKeyNXHSSIGRWJENBH-UHFFFAOYSA-N
InChIInChI=1S/C7H4N2O2S/c10-9(11)7-3-1-6(2-4-7)8-5-12/h1-4H
LabNetwork Molecule IDLN00239877
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分类

  • {SNA} Building Blocks, Chemical Synthesis, Organic Building Blocks, Sulfur Compounds, Thiocyanates/Isothiocyanates
  • {uni_hamburg} no charge; carbocycle; aromatic; 6RingOnly; 6ring; 1fragment

相关文献及参考

  • Short: IV/1a Title: Densities of Liquid Systems: Nonaqueous Systems and Ternary Aqueous Systems Author: Lacmann, R.; Synowietz, C. Editor: Schäfer, Kl. Source: Landolt-Börnstein, New Series Volume: IV/1a Year: 1974 ISBN: 3-540-06269-6 ISBN: 978-3-540-06269-1 Internet Resource: DOI:10.1007/b20003 RefComment: X, 716 pages. Hardcover Abstract: Volume IV/1 contains information on the densities of liquid systems. It may be considered as a supplement to volume II/1 of the 6th Edition, which contains only a few data on nonaqueous systems. Data are not listed for all systems but primarily for those of greater interest where data for a larger range of concentrations were available.
  • Short: EINECS2 Title: Corrigendum to the Commission communication pursuant to Article 13 of Council Directive 67/548/EEC of 27 June 1967 on the approximation of the laws, regulations and administrative provisions relating to the classification, packaging and labelling of dangerous substances, as amended by Directive 79/831/EEC - Einecs (European inventory of existing commercial chemical substances) Source: Official Journal of the European Communities Volume: C 54 (01.03.2002) Page: 13-27 Year: 2002 Internet Resource: http://eur-lex.europa.eu/LexUriServ/LexUriServ.do?uri=OJ:C:2002:054:SOM:EN:HTML Internet Resource: http://eur-lex.europa.eu/LexUriServ/LexUriServ.do?uri=OJ:C:2002:054:0013:0027:EN:PDF Internet Resource: http://ecb.jrc.ec.europa.eu/esis/index.php?PGM=ein Publish_Date: 2002/03/01

安全信息

WGK Germany3
GHS Symbol
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。
  • 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。
  • P271 Use only outdoors or in a well-ventilated area.? 只能在室外或通风良好的地方使用。
  • 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。
  • 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。
  • P284 Wear respiratory protection.? 佩戴呼吸保护装置。
  • P285 In case of inadequate ventilation wear respiratory protection. 在通风不足的情况下，戴呼吸防护。
  • P301+P310+P330
  • P301+P312
  • P302+P350
  • P302+P352
  • P302+P352+P332+P313+P362+P364
  • P304+P312
  • P304+P340
  • P304+P340+P311
  • P304+P341
  • 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。
  • P321 Specific treatment (see … on this label). 具体治疗（见本标签上的）。
  • P322 Specific measures (see …on this label). 具体治疗（见本标签上的）。
  • P330 Rinse mouth. 漱口
  • P332+P313
  • P333+P313
  • P337+P313
  • P342+P311
  • 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
  • P363 Wash contaminated clothing before reuse. 被污染的衣服洗净后方可重新使用。
  • P403+P233
  • P405 Store locked up. 上锁保管。
  • P501 Dispose of contents/container to..… 处理内容物/容器.....
Hazard statements
  • H301+H331
  • H302 Harmful if swallowed 吞食有害
  • H312 Harmful in contact with skin 皮肤接触有害
  • 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
  • H332 Harmful if inhaled 吸入有害
  • H334 May cause allergy or asthma symptoms or breathing difficulties if inhaled 吸入可能导致过敏或哮喘症状或呼吸困难
  • H335 May cause respiratory irritation 可能导致呼吸道刺激
Personal Protective Equipment dust mask type N95 (US), Eyeshields, Faceshields, Gloves
Signal word Danger
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；
  • S22 Do not breathe dust 不要吸入粉尘；
  • 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；
  • 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）；
Packing GroupIII
UN Number 2811 UN2923
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
  • R42 May cause sensitisation by inhalation 吸入会产生过敏反应
  • 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
  • R34 Causes burns 会导致灼伤
Storage condition Moisture Sensitive
Hazard Codes Xn
Hazard Class6.1

其他信息

  • Sigma Aldrich:2131-61-5(sigmaaldrich)
  • MOL 文件:2131-61-5.mol
  • Alfa Aesar:4-硝基苯硫代异氰酸酯,97% 4-Nitrophenyl isothiocyanate, 97%(2131-61-5)
  • Acros Organics:异硫代氰基4-硝基苯酯 4-Nitrophenyl isothiocyanate, 98%(2131-61-5)
  • 异硫代氰基4-硝基苯酯价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2014/06/02 N0826 异硫氰酸4-硝基苯酯 4-Nitrophenyl Isothiocyanate 25G 1010元 2014/06/02 N0826 异硫氰酸4-硝基苯酯 4-Nitrophenyl Isothiocyanate 5G 331元 2010/06/21 AC41607EA 异硫代氰基4-硝基苯酯 4-nitrophenyl isothiocyanate 10 GR 315元
  • F:10-21
  • TCI Shanghai:4-硝基苯基异硫氰酸酯 4-Nitrophenyl Isothiocyanate,>;98.0%(GC)(2131-61-5)
  • 图谱信息:异硫代氰基4-硝基苯酯(2131-61-5)核磁图( 1 HNMR) 异硫代氰基4-硝基苯酯(2131-61-5)红外图谱(IR1) 异硫代氰基4-硝基苯酯(2131-61-5)质谱(MS) 异硫代氰基4-硝基苯酯(2131-61-5)核磁图( 13 CNMR) 异硫代氰基4-硝基苯酯(2131-61-5)红外图谱(IR2)
  • 敏感性:Moisture Sensitive

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. Nitrogen Compounds 氮化合物
  5. Isocyanides - Nitrogen Compounds
  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Organic Building Blocks 有机砌块
  4. Sulfur Compounds 硫化合物
  5. Thiocyanates/Isothiocyanates - Sulfur Compounds
  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Organic Building Blocks 有机砌块
  4. Sulfur Compounds 硫化合物
  5. Thiocyanates/Isothiocyanates - Sulfur Compounds
  1. Chemical Synthesis 化学合成
  2. Building Blocks 合成砌块
  3. Organic Building Blocks 有机砌块
  4. Sulfur Compounds 硫化合物
  5. Thiocarbonyl Compounds
  1. Functional Group 官能团索引
  2. isothiocyanate

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