Isothiocyanic acid, (p-cetoxyphenyl) ester

CAS 6637-40-7 MFCD N/A

化学结构图

6637-40-7
SMILES: CCCCCCCCCCCCCCCCOc1ccc(N=C=S)cc1

化学属性

Mol. FormulaC23H37NOS
Mol. Weight375.67

别名和识别编码

Chemical NameIsothiocyanic acid, (p-cetoxyphenyl) ester
Chemicalbook IDCB72287590
Synonym p-Cetoxyphenylisothiocyanate
Wiswesser Line NotationSCNR DO16
CAS Number6637-40-7
Beilstein Registry Number3425268
InChIKeyQZYKAALLMYWYRA-UHFFFAOYSA-N
PubChem Substance ID23123
InChIInChI=1S/C23H37NOS/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-20-25-23-18-16-22(17-19-23)24-21-26/h16-19H,2-15,20H2,1H3
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安全信息

RTECSNX8450000 
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intraperitoneal
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 150 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: AD691-490

系列性分类

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