Metrizoic Acid 3-乙酰氨基-5-(N-甲基乙酰胺)-2,4,6-三碘苯甲酸

CAS 1949-45-7 MFCD00867964

化学结构图

1949-45-7
SMILES: CC(=O)Nc1c(I)c(C(=O)O)c(I)c(N(C)C(C)=O)c1I

化学属性

Mol. FormulaC12H11I3N2O4
Mol. Weight627.94
Boiling Point678.8 °C at 760 mmHg

别名和识别编码

Chemical NameMetrizoic Acid
CAS Number1949-45-7
Synonym 3,5-Diacetamido-N-methyl-2,4,6-triiodobenzoic Acid 3-(Acetylamino)-5-(acetylmethylamino)-2,4,6-triiodobenzoic Acid 3-(Acetylamino)-5-[acetyl methyl-amino)2,4,6-triiodobenzoic acid 3-(acetylamino)-5-(acetylmethylamino)-2,4,6-triiodo-benzoicaci 3-ACETAMIDO-5-(N-METHYLACETAMIDO)-2,4,6-TRIIODOBENZOIC ACID 3-Acetamido-2,4,6-triiodo-5-(N-methylacetamido)benzoic Acid 3-Acetylamino-5-(N-methylacetylamino)-2,4,6-triiodobenzoic acid 3-Acetylamino-5-[acetyl(methyl)amino]-2,4,6-triiodobenzoic acid; 3-Acetamido-2,4,6-triiodo-5-N-methylacetamidobenzoic acid 3-acetamido-2,4,6-triiodo-5-(n-methylacetamido)-benzoicaci 3-acetamido-2,4,6-triiodo-5-N-methylacetamidobenzoic acid 3-乙酰氨基-5-[乙酰(甲基)氨基]-2,4,6-三碘苯甲酸 Benzoic acid, 3-(acetylamino)-5-(acetylmethylamino)-2,4,6-triiodo- Isopaque METRIZOIC ACID Metrizoate
MDL NumberMFCD00867964
EC Number217-761-1
Reaxys-RN2822724
PubChem Substance ID2528
Merck Number6156
Chemical Name Translation3-乙酰氨基-5-(N-甲基乙酰胺)-2,4,6-三碘苯甲酸
Wiswesser Line Notation1VN1&R BI DI FI CVQ EMV1
Beilstein Registry Number2822724
LabNetwork Molecule IDLN01290433
InChIInChI=1S/C12H11I3N2O4/c1-4(18)16-10-7(13)6(12(20)21)8(14)11(9(10)15)17(3)5(2)19/h1-3H3,(H,16,18)(H,20,21)
Canonical SMILESO=C(O)C1=C(I)C(N(C(C)=O)C)=C(I)C(NC(C)=O)=C1I
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分类

  • Amines
  • Aromatics
  • Diagnostic
  • Pharmaceuticals
  • Intermediates & Fine Chemicals

产品应用

  • Diagnosis aid (radiopaque medium).

相关文献及参考

  • Pitre, F., et al.: Farmaco Ed. Sci., 17, 340 (1962),

安全信息

RTECSDG0887300
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
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : 38100 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   NIIRDN Drugs in Japan (Ethical Drugs).  (Yakugyo Jiho Co.

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intracerebral
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 234 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   NIIRDN Drugs in Japan (Ethical Drugs).  (Yakugyo Jiho Co., Ltd., Tokyo,
   Japan)  Volume(issue)/page/year: 6,843,1982

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intravenous
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 10 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: 17,340,1962

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Subcutaneous
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : 29600 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   NIIRDN Drugs in Japan (Ethical Drugs

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Subcutaneous
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 36 gm/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   NIIRDN Drugs in Japan (Ethical Drugs).  (Yakugyo Jiho Co., Ltd., Tokyo,
   Japan)  Volume(issue)/page/year: 6,843,19

Storage condition 2-8°C
Hazard statements
  • H315 Causes skin irritation 会刺激皮肤
  • H319 Causes serious eye irritation 严重刺激眼睛
  • H335 May cause respiratory irritation 可能导致呼吸道刺激
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。
  • P264+P265
  • 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。
  • 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。
  • P302+P352
  • P304+P340
  • P305+P351+P338
  • 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。
  • P319
  • P321 Specific treatment (see … on this label). 具体治疗（见本标签上的）。
  • P332+P313
  • P332+P317
  • P337+P313
  • P337+P317
  • 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
  • P362+P364
  • P403+P233
  • P405 Store locked up. 上锁保管。
  • P501 Dispose of contents/container to..… 处理内容物/容器.....

其他信息

  • TCI Shanghai:甲泛影酸 Metrizoic Acid,>;98.0%(LC)(T)(1949-45-7)
  • 甲泛影酸价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2014/06/02 M1363 甲泛影酸 Metrizoic Acid 25G 2020元
  • MOL 文件:1949-45-7.mol

系列性分类

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