2,6-Dinitrotoluene 2,6-二氯甲苯/XJB

CAS 606-20-2 MFCD00007158

化学结构图

606-20-2
SMILES: Cc1c([N+](=O)[O-])cccc1[N+](=O)[O-]

化学属性

Mol. FormulaCH3C6H3(NO2)2
Mol. Weight182.13
Density1.2833
Melting Point56-61 °C(lit.)
Flash Point207°(404°F)
TSCAYes
Boiling Point285°C
Solubility0.0182 G/100 ML

别名和识别编码

Chemical Name2,6-Dinitrotoluene
Synonym 1,3-Dinitro 2-methyl benzene 1-Methyl-2,6-dinitrobenzene 1-methyl-2,6-dinitrobenzene 2,4-/2,6-DINITROTOLUENEMIXTURE 2,6-DINITROTOLUENE 2,6-DINITROTOLUENE MOISTENED WITH WATER (H2O ~10%) 2,6-DINITROTOLUENE OEKANAL, 250 MG 2,6-DINITROTOLUENE, 1000MG, NEAT 2,6-DINITROTOLUENE, 1X1ML, MEOH, 5000UG/ ML 2,6-DNT 2,6-Dinitro-toluol 2,6-Dinitrotoluene 2,6-Dinitrotoluene,97% 2,6-Dinitrotoluene,~99% 2,6-Dinitrotoluol 2,6-Dnt 2,6-dinitro-toluen 2,6-dinitro-toluene 2,6-dinitrotoluene 2,6-dinitrotoluene solution 2,6-二硝基甲苯 2,6-二硝基甲苯,97% 2,6-二硝基甲苯2,6-二硝基甲苯 2-Methyl-1,3-dinitro-benzene 2-Methyl-1,3-dinitrobenzene 2-Met
CAS Number606-20-2
EC Number210-106-0
Beilstein Registry Number2052046
MDL NumberMFCD00007158
PubChem Substance ID11813
Chemical Name Translation2,6-二氯甲苯/XJB
Wiswesser Line NotationWNR B1 CNW
InChIInChI=1S/C7H6N2O4/c1-5-6(8(10)11)3-2-4-7(5)9(12)13/h2-4H,1H3
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分类

  • {SNA} Analytical Standards, Analytical/Chromatography, Chromatography, Plasticizer, Standards for Personal Care and Cosmetic Products, neats, prohibited substances (EU-REGULATION No 1223/2009)
  • {uni_hamburg} no charge; carbocycle; aromatic; 6RingOnly; 6ring; 1fragment
  • {SNA} Building Blocks, Chemical Synthesis, Nitro Compounds, Nitrogen Compounds, Organic Building Blocks

相关文献及参考

  • Short: IV/20C
  • Beilstein:5,341
  • Short: IV/1a
  • Short: III/5a
  • Short: IV/20B

安全信息

Signal word Danger
GHS Symbol
WGK Germany3
Safety Statements
  • S61 Avoid release to the environment. Refer to special instructions/safety data sheet 避免释放到环境中,参考特别指示/安全收据说明书;
  • 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);
  • S53 Avoid exposure - obtain special instructions before use 避免接触,使用前获得特别指示说明;
  • S456
  • 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;
  • 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;
Risk Statements
  • 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
  • R45 May cause cancer 可能致癌
  • R62 Possible risk of impaired fertility 有削弱生殖能力的危险
  • R48/22
  • R52/53
  • R68 Possible risk of irreversible effects 可能有不可挽回的作用的危险
  • 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
  • R11 Highly flammable 非常易燃
  • R36/37/38 Irritating to eyes, respiratory system and skin 对眼睛、呼吸系统和皮肤有刺激性
Precautionary statements
  • P201 Obtain special instructions before use. 使用前获取专门指示。
  • P202 Do not handle until all safety precautions have been read and understood. 已阅读并理解所有的安全预防措施之前,切勿操作。
  • 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。
  • 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。
  • 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。
  • P281 Use personal protective equipment as required. 使用所需的个人防护装备。
  • P284 Wear respiratory protection.? 佩戴呼吸保护装置。
  • P301+P310
  • P301+P312
  • P302+P352
  • P304+P340
  • P307+P311
  • P308+P313
  • P309+P311
  • P310 Immediately call a POISON CENTER or doctor/physician. 立即呼救解毒中心或医生/医师。
  • P311 Call a POISON CENTER or doctor/physician. 呼叫解毒中心或医生/医师。
  • 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。
  • 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
  • P320 Specific treatment is urgent (see … on this label). 紧急具体治疗(见本标签上的)。
  • 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
  • P361 Remove/Take off immediately all contaminated clothing. 立即去除/脱掉所有被污染的衣服。
  • P363 Wash contaminated clothing before reuse. 被污染的衣服洗净后方可重新使用。
  • P391 Collect spillage. Hazardous to the aquatic environment 收集对水环境有危害的泄漏物。
  • 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 Toxic if swallowed 吞食有毒
  • H311 Toxic in contact with skin 皮肤接触中毒
  • H331 Toxic if inhaled 吸入中毒
  • H341 Suspected of causing genetic defects 怀疑导致遗传性缺陷
  • H350 May cause cancer 可能致癌
  • H361 Suspected of damaging fertility or the unborn child 怀疑对生育能力或未出生婴儿造成伤害
  • H373 May causes damage to organs through prolonged or repeated exposure 长期或频繁接触可能会损伤器官
  • H412 Harmfutoaquaticlifewithlonglastingeffects 对水生生物有害并具有长期影响。
Personal Protective Equipment Eyeshields, Faceshields, full-face particle respirator type N100 (US), Gloves, respirator cartridge type N100 (US), type P1 (EN143) respirator filter, type P3 (EN 143) respirator cartridges dust mask type N95 (US), Eyeshields, Faceshields, Gloves, type P2 (EN 143) respirator cartridges
RTECSXT1925000
Packing GroupII
UN Number 3454 UN 3454 6.1/PG 2 UN3454
Hazard Codes T T,F
Hazard Class6.1
Storage condition 2-8°C
Restrict 易制爆危险化学品
Warnings 危化品目录(2015) 危险化学品
TYPE OF TEST            : TD - Toxic dose (other than lowest)
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : 5110 mg/kg/1Y-C
TOXIC EFFECTS :
   Tumorigenic - equivocal tumorigenic agent by RTECS criteria
   Liver - tumors
REFERENCE :
   PAACA3 Proceedings of the American Association for Cancer Research. (Waverly
   Press, 428 E. Preston St., Baltimore, MD 21202)  V.1-    1954-
   Volume(issue)/page/year: 24,91,1983

TYPE OF TEST            : TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : 2555 mg/kg/1Y-C
TOXIC EFFECTS :
   Tumorigenic - Carcinogenic by RTECS criteria
   Liver - tumors
REFERENCE :
   JJIND8 JNCI, Journal of the National Cancer Institute.  (Washington, DC)
   V.61-79, 1978-87. For publisher information, see JNCIEQ.
   Volume(issue)/page/year: 79,1313,1987

TYPE OF TEST            : LC50 - Lethal concentration, 50 percent kill
ROUTE OF EXPOSURE       : Inhalation
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : 240 mg/m3/6H
TOXIC EFFECTS :
   Behavioral - general anesthetic
   Lungs, Thorax, or Respiration - fibrosing alveolitis
   Lungs, Thorax, or Respiration - changes in lung weight
REFERENCE :
   NTIS** National Technical Information Service.  (Springfield, VA 22161)
   Formerly U.S. Clearinghouse for Scientific & Technical Information.
   Volume(issue)/page/year: OTS0533663

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 621 mg/kg
TOXIC EFFECTS :
   Behavioral - somnolence (general depressed activity)
REFERENCE :
   NTIS** National Technical Information Service.  (Springfield, VA 22161)
   Formerly U.S. Clearinghouse for Scientific & Technical Information.
   Volume(issue)/page/year: AD-A080-146

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : 177 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   NTIS** National Technical Information Service.  (Springfield, VA 22161)
   Formerly U.S. Clearinghouse for Scientific & Technical Information.
   Volume(issue)/page/year: PB214-270

TYPE OF TEST            : DNA adduct
ROUTE OF EXPOSURE       : Administration onto the skin
TEST SYSTEM             : Rodent - mouse
DOSE/DURATION           : 192 umol/kg
REFERENCE :
   CRNGDP Carcinogenesis (London). (Oxford Univ. Press, Pinkhill House,
   Southfield Road, Eynsham, Oxford OX8 1JJ, UK)  V.1-    1980-
   Volume(issue)/page/year: 5,231,1984

TYPE OF TEST            : Mutation test systems - not otherwise specified
ROUTE OF EXPOSURE       : Oral
TEST SYSTEM             : Rodent - rat
DOSE/DURATION           : 10 mg/kg
REFERENCE :
   JTEHD6 Journal of Toxicology and Environmental Health.  (Hemisphere Pub.,
   1025 Vermont Ave., NW, Washington, DC 20005)  V.1-    1975/76-
   Volume(issue)/page/year: 11,55

TYPE OF TEST            : DNA damage
TEST SYSTEM             : Rodent - rat Liver
DOSE/DURATION           : 3 mmol/L
REFERENCE :
   SinJF# Personal Communication from J.F. Sina, Merck Institute for
   Therapeutic Research, West Point, PA 19486, Oct. 26, 1982
   Volume(issue)/page/year: 26OCT1982

TYPE OF TEST            : DNA adduct
ROUTE OF EXPOSURE       : Intraperitoneal
TEST SYSTEM             : Rodent - rat
DOSE/DURATION           : 219 ug/kg
REFERENCE :
   MUREAV Mutation Research.  (Elsevier Science Pub. B.V., POB 211, 1000 AE
   Amsterdam, Netherlands) V.1-    1964-  Volume(issue)/page/year: 301,79,1993

TYPE OF TEST            : Unscheduled DNA synthesis
ROUTE OF EXPOSURE       : Oral
TEST SYSTEM             : Rodent - rat
DOSE/DURATION           : 5 mg/kg
REFERENCE :
   CRNGDP Carcinogenesis (London). (Oxford Univ. Press, Pinkhill House,
   Southfield Road, Eynsham, Oxford OX8 1JJ, UK)  V.1-    1980-
   Volume(issue)/page/year: 3,241,1982

TYPE OF TEST            : Mutation in microorganisms
TEST SYSTEM             : Bacteria - Salmonella typhimurium
DOSE/DURATION           : 100 ug/plate
REFERENCE :
   DTE

TYPE OF

其他信息

  • 用途二:工业上大多应用2,4-二硝基甲苯和2,6-二硝基甲苯的混合物,经还原为2,6/2,4-二氨基甲苯,然后经光气化生产甲苯二异氰酸酯(TDI)。也可用于其他有机合成。
  • 灭火剂:二氧化碳、砂土、泡沫
  • 溶于乙醇。能随水蒸气挥发。
  • 用途一:用于有机合成和炸药的制备
  • 刺激数据:皮肤-兔子 500 毫克/24小时 轻度
  • 爆炸物危险特性:与氧化剂混合可爆
  • 上游原料:2-硝基甲苯 --> 2,4-二硝基甲苯
  • 检测方法:GC,NMR
  • 下游产品:4-羟基吲哚 --> 2-氨基-6-甲氧基苯甲酸
  • 类别:有毒物品
  • Sigma Aldrich:606-20-2(sigmaaldrich)
  • 储运特性:库房通风低温干燥; 与氧化剂、还原剂、酸类分开储运
  • 外观性质:浅黄色针状结晶。
  • 2,6-二硝基甲苯价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2011/08/23 80057281 2,6-二硝基甲苯;2-甲基-1,3-二硝基苯 100g 150元 2011/04/16 D1151 2,6-二硝基甲苯 2,6-Dinitrotoluene 25G 509元 2010/05/25 L00856 2,6-二硝基甲苯, 97% 2,6-Dinitrotoluene, 97% 5g 290元
  • TCI Shanghai:2,6-二硝基甲苯 2,6-Dinitrotoluene,>;99.0%(GC)(606-20-2)
  • 急性毒性:口服-大鼠 LD50: 177 毫克/ 公斤; 口服-小鼠 LD50: 621 毫克/公斤
  • Alfa Aesar:2,6-二硝基甲苯,97% 2,6-Dinitrotoluene, 97%(606-20-2)
  • 方法一:由邻硝基甲苯经混酸硝化而得。生产过程与2,4-二硝基甲苯相同。
  • MOL 文件:606-20-2.mol
  • 可燃性危险特性:明火可燃; 受热分解有毒氮氧化物气体
  • 毒性分级:高毒
  • 图谱信息:2,6-二硝基甲苯(606-20-2)红外图谱(IR2) 2,6-二硝基甲苯(606-20-2)红外图谱(IR1) 2,6-二硝基甲苯(606-20-2)Raman光谱 2,6-二硝基甲苯(606-20-2)核磁图( 1 HNMR) 2,6-二硝基甲苯(606-20-2)质谱(MS) 2,6-二硝基甲苯(606-20-2)核磁图( 13 CNMR)
  • MSDS 信息:2,6-二硝基甲苯(606-20-2).msds
  • 职业标准:TWA 1.5 毫克/ 立方米

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