3,4-Dinitrotoluene 3,4-二硝基甲苯

CAS 610-39-9 MFCD00007270

化学结构图

610-39-9
SMILES: Cc1ccc([N+](=O)[O-])c([N+](=O)[O-])c1

化学属性

Mol. FormulaC7H6N2O4
Mol. Weight182.15
Melting Point54-57 °C(lit.)
Flash Point>;230 °F
Appearance 黄色针状结晶。熔点61℃。不溶于水。

别名和识别编码

Chemical Name3,4-Dinitrotoluene
Synonym 1,2-Dinitro4-methylbenzene 1-METHYL-3,4-DINITROBENZENE 1-methyl-3,4-dintriobenzene 3,4-DINITROTOLUENE 3,4-DNT 3,4-Dinitro-toluol 3,4-Dinitrotoluene 3,4-Dinitrotoluol 3,4-dinitro-toluen 3,4-dinitro-toluene 3,4-dinitrotoluene 3,4-二硝基甲苯 3,4-二硝基甲苯,99% 4-Methyl-1,2-dinitrobenzene 4-methyl-1,2-dinitro-benzen 4-甲基-1,2-二硝基苯 5-METHYL-1,2-DINITROBENZENE Benzene, 4-methyl-1,2-dinitro- Benzene,4-methyl-1,2-dinitro- EPA Method 529 Internal Standard Stock Solution Toluene, 3,4-dinitro- benzene, 1-methyl-3,4-dinitro- benzene,1-methyl-3,4-dinitro- {} {uni_hamburg}
MDL NumberMFCD00007270
CAS Number610-39-9
PubChem Substance ID11883
EC Number210-222-1
Beilstein Registry Number5,341
Reaxys-RN2213131
Chemical Name Translation3,4-二硝基甲苯
Wiswesser Line NotationWNR D1 FNW
LabNetwork Molecule IDLN01114886
InChIInChI=1S/C7H6N2O4/c1-5-2-3-6(8(10)11)7(4-5)9(12)13/h2-4H,1H3
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分类

  • {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/8A Title: Enthalpies of Fusion and Transition of Organic Compounds Author: Zhang, Z.-Y.; Frenkel, M.; March, K.N.; Wilhoit, R.C. Editor: Marsh, K.N. Source: Landolt-Börnstein, New Series Volume: IV/8A Year: 1995 Keyword: organic compounds; enthaly of fusion; melting point; phase transition ISBN: 3-540-58854-X ISBN: 978-3-540-58854-2 Internet Resource: DOI:10.1007/b55145 RefComment: VIII, 588 pages.
  • 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

GHS Symbol
WGK Germany3
Hazard statements
  • H301 Toxic if swallowed 吞食有毒
  • H301+H311+H331
  • H302 Harmful if swallowed 吞食有害
  • 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
  • H411 Toxictoaquaticlifewithlonglastingeffects 对水生生物有毒性并具有长期影响。
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
RTECSXT2100000
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。
  • 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。
  • 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。
  • P301+P310
  • P301+P312
  • P301+P312+P330
  • P302+P350
  • P302+P352
  • P304+P340
  • P304+P340+P311
  • P308+P313
  • P309+P311
  • 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
  • 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
  • P333+P313
  • 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.....
Signal word Danger
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;
Hazard Codes T,N
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
  • R48/22
  • R45 May cause cancer 可能致癌
  • R68 Possible risk of irreversible effects 可能有不可挽回的作用的危险
  • R62 Possible risk of impaired fertility 有削弱生殖能力的危险
  • R51/53
UN Number 3454 UN 3454 6.1/PG 2
Packing GroupII
Hazard Class6.1
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : 807 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: AD-A080-146

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 747 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            : Mutation in microorganisms
TEST SYSTEM             : Bacteria - Salmonella typhimurium
DOSE/DURATION           : 1 mg/plate
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            : Mutation in microorganisms
TEST SYSTEM             : Bacteria - Salmonella typhimurium
DOSE/DURATION           : 10 ug/plate
REFERENCE :
   ENMUDM Environmental Mutagenesis.  (New York, NY)  V.1-9, 1979-87.  For
   publisher information, see EMMUEG.  Volume(issue)/page/year: 4,163,1982

TYPE OF TEST            : DNA damage
TEST SYSTEM             : Rodent - rat Liver
DOSE/DURATION           : 300 umol/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

其他信息

  • 用途一:用于有机合成。
  • 方法一:间硝基甲苯用混酸硝化。硝化反应在80℃进行,反应时间半小时。
  • MOL 文件:610-39-9.mol
  • 上游原料:3-硝基甲苯
  • 3,4-二硝基甲苯价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2014/06/02 D1152 3,4-二硝基甲苯 3,4-Dinitrotoluene 5G 418元
  • Sigma Aldrich:610-39-9(sigmaaldrich)
  • 图谱信息:3,4-二硝基甲苯(610-39-9)红外图谱(IR2) 3,4-二硝基甲苯(610-39-9)核磁图( 13 CNMR) 3,4-二硝基甲苯(610-39-9)质谱(MS) 3,4-二硝基甲苯(610-39-9)Raman光谱 3,4-二硝基甲苯(610-39-9)红外图谱(IR1) 3,4-二硝基甲苯(610-39-9)核磁图( 1 HNMR)
  • TCI Shanghai:3,4-二硝基甲苯 3,4-Dinitrotoluene,>;98.0%(GC)(610-39-9)

系列性分类


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