3-Acetamido-2,4,6-Triiodobenzoic Acid 3-乙酰氨基-2,4,6-三碘苯甲酸

CAS 85-36-9 MFCD00016495

化学结构图

85-36-9
SMILES: CC(=O)NC1=C(I)C=C(I)C(C(O)=O)=C1I

化学属性

Mol. FormulaC9H6I3NO3
Mol. Weight556.86
Appearance 白色结晶粉末,溶于水。熔点278-283℃

别名和识别编码

Chemical Name3-Acetamido-2,4,6-Triiodobenzoic Acid
MDL NumberMFCD00016495
CAS Number85-36-9
Synonym 3-乙酰氨基-2,4,6-三碘苯甲酸 Benzoic acid, 3-acetamido-2,4,6-triiodo- opacaron Urokonic acid ACETRIAZOIC ACID urokon 醋碘苯酸 Acido 3-acetilamino-2,4,6-triiodobenzoico 乙碘苯酸 3-Acetamino-2,4,6-triiodobenzoic acid 乙酰碘佐酸 Benzoicacid,3-(acetylamino)-2,4,6-triiodo- Benzoic acid, 3-(acetylamino)-2,4,6-triiodo- 3-乙酰氨基-2,4,6-三碘代苯甲酸 3-ACETAMINO-2,4,6-TRIIODOBENZOIC ACID 2,4,6-Triiodo-3-acetylaminobenzoic acid 3-acetamido-2,4,6-triiodo-benzoicaci 3-Acetamido-2,4,6-triiodobenzoic acid 溶剂红23 acido3-acetilamino-2,4,6-triiodobenzoico 3-(Acetylamino)-2,4,6-triiodobenzoic acid Opacaron ACETRIZOIC ACID 2,4,6-TRIIODO-3-ACETAMIDOBENZOIC ACID 3-ACETYLAMINO-2,4,6-TRIIODOBENZOIC ACID Acetrizoic acid 3-(acetylamino)-2,4,6-triiodo-benzoicaci 3-ACETAMIDO-2,4,6-TRIIODOBENZOIC ACID 3-Acetylamino-2,4,6-triiodobenzoic acid 2,4,6-Triiodo-3-acetamidobenzoic acid urokonicacid Urokon
EC Number201-600-7
Reaxys-RN2219129
PubChem Substance ID87562373
Chemical Name Translation3-乙酰氨基-2,4,6-三碘苯甲酸
Wiswesser Line NotationQVR BI DI FI CMV1
Beilstein Registry Number2219129
LabNetwork Molecule IDLN01343380
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分类

  • {uni_hamburg} no charge; carbocycle; aromatic; 6RingOnly; 6ring; carboxylic acid; amide; 1fragment

相关文献及参考

  • Short: III/20c Title: Nuclear Quadrupole Resonance Spectroscopy Data: Nuclei Zr ... Bi. Diagrams, Structure formulas, Indexes Author: Chihara, H.; Nakamura, N. Editor: Hellwege, K.-H.; Hellwege, A.M. Source: Landolt-Börnstein, New Series Volume: III/20c Year: 1989 Keyword: NQR ISBN: 3-540-18490-2 ISBN: 978-3-540-18490-4 Internet Resource: DOI:10.1007/b35374 RefComment: 562 figs., IX,802 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/31b Title: Nuclear Quadrupole Resonance Spectroscopy Data: Nuclei Zn ... Bi. Diagrams, Indexes Author: Chihara, H.; Nakamura, N. Editor: Hellwege, K.-H.; Hellwege, A.M. Source: Landolt-Börnstein, New Series Volume: III/31b Year: 1993 Keyword: NQR ISBN: 3-540-55147-6 ISBN: 978-3-540-55147-8 Internet Resource: DOI:10.1007/b46097 RefComment: 147 figs., VIII, 347 pages. Hardcover Abstract: Volume III/31 continues the compilation of nuclear quadrupole resonance spectroscopy data of solid substances which started in with volume III/20 in 1987 covering the literature from the beginning of nuclear quadrupole resonance spectroscopy in 1951 to 1982 and containing the data for 8000 substances in the solid state, distributed among three subvolumes III/20 a, b, and c. Volume III/31 covers the literature published in the period from the end of 1982 through the end of 1989. Included are the data for substances studied for the first time, as well as data for substances already present in the previous volume III/20 if the data published there could be completed or improved by new studies. In total there are 2500 substances i

安全信息

RTECSDG0887000
Signal word
Hazard statements
  • H315 Causes skin irritation 会刺激皮肤
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。
  • P302+P352+P332+P313+P362+P364
  • P332+P313
  • P305+P351+P338+P337+P313
  • P302+P350
  • P337+P313
  • P305+P351+P338
Safety Statements
  • 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;
  • 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
GHS Symbol
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intravenous
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 8 gm/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   FRPSAX Farmaco, Edizione Scientifica. (Casella Postale 227, 27100 Pavia,
   Italy)  V.8-43 1953-88 For publisher information, see FRMCE8
   Volume(issue)/page/year: 18,33,1963

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Unreported
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : 9650 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   JAPMA8 Journal of the American Pharmaceutical Association, Scientific
   Edition.  (Washington, DC) V.29-49, 1940-60.  For publisher information, see
   JPMSAE.  Volume(issue)/page/year: 42,721,1953

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 20 gm/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   FRPSAX Farmaco, Edizione Scientifica. (Casella Postale 227, 27100 Pavia,
   Italy)  V.8-43 1953-88 For publisher information, see FRMCE8
   Volume(issue)/page/year: 18,33,1963

其他信息

  • Sigma Aldrich:85-36-9(sigmaaldrich)
  • 方法一:3-氨基-2,4,6-三碘苯甲酸钠(见02780)乙酰化而得:先后将乙酐、硫酸加入反应罐,冷却至40℃后加入3-氨基-2,4,6-三碘笨甲酸钠。升温,于80℃反应3小时。冷却至室温,甩滤,用蒸馏水洗,得醋碘笨酸粗品。将粗品加水和EDTA搅拌1小时,过滤,用水冲洗4次。再将醋碘苯酸加入罐内,用氨水调节pH至8.5。过滤,用95%乙醇反复泡洗,滤去乙醇,得醋碘苯酸铵。将其溶解于蒸馏水,加活性炭脱色过滤,滤液用3N盐酸调节pH至1,再过滤,用50℃热蒸馏水洗至无氯离子,烘干,得醋碘苯酸。
  • 储运特性:库房通风低温干燥
  • 醋碘苯酸价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2014/06/02 A0858 醋碘苯酸 Acetrizoic Acid 5G 2600元 2014/06/02 A0858 醋碘苯酸 Acetrizoic Acid 1G 956元
  • TCI Shanghai:醋碘苯酸 Acetrizoic Acid,>;98.0%(T)(85-36-9)
  • 上游原料:苯 --> 活性炭(脱色) --> 苯甲酸钠 --> 2,3,5-三碘苯甲酸
  • 毒性分级:低毒
  • 图谱信息:醋碘苯酸(85-36-9)红外图谱(IR1) 醋碘苯酸(85-36-9)质谱(MS) 醋碘苯酸(85-36-9)核磁图( 13 CNMR) 醋碘苯酸(85-36-9)核磁图( 1 HNMR) 醋碘苯酸(85-36-9)红外图谱(IR2)
  • 灭火剂:干粉、泡沫、砂土和水
  • 急性毒性:口服-小鼠LD50:20000毫克/公斤;静脉-小鼠 LD50: 8000 毫克/公斤
  • MOL 文件:85-36-9.mol
  • 用途一:造影剂,适宜于肾盂、尿道、膀胱,以及心血管造影。
  • 可燃性危险特性:可燃;加热分解释放有毒氮氧化物, 碘化物烟雾
  • 类别:有毒物品

系列性分类


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