1-Methyl-3-Phenylthiourea 1-甲基-3-苯基硫脲

CAS 2724-69-8 MFCD00022130

化学结构图

2724-69-8
SMILES: CNC(=S)Nc1ccccc1

化学属性

Mol. FormulaC8H10N2S
Mol. Weight166.24
Melting Point113 °C
Boiling Point247.4±23.0 °C at 760 mmHg

别名和识别编码

Chemical Name1-Methyl-3-Phenylthiourea
CAS Number2724-69-8
Alfabeta NameMETHYLPHENYLTHIOUREA 132-----
MDL NumberMFCD00022130
Synonym 3-Methyl-1-phenylthiourea {LY} 3-Methyl-1-phenylthiourea {} {LY} 3-Methyl-1-phenylthiourea {} {} {LY} 3-Methyl-1-phenylthiourea {} {} {} {LY} 3-Methyl-1-phenylthiourea {} {} {} {} {LY} 3-Methyl-1-phenylthiourea {} {} {} {} {} {} {} {} {} {} {LY} 3-Methyl-1-phenylthiourea {} {} {} {} {} {} {LY} 3-Methyl-1-phenylthiourea {} {} {} {} {} {} {} {LY} 3-Methyl-1-phenylthiourea {} {} {} {} {} {} {} {} {LY} 3-Methyl-1-phenylthiourea {} {} {} {} {} {} {} {} {} {LY} 3-Methyl-1-phenylthiourea {} {} {} {} {} {} {} {} {} {} {LY} 3-Methyl-1-phenylthiourea {} {} {} {} {} {} {} {} {} {} {} {LY} 3-Methyl-1-phenylthiourea {} {} {} {} {} {} {} {} {} {} {} {} {LY} 3-Methyl-1-phenylthiourea {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 3-Methyl-1-phenylthiourea {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 3-Methyl-1-phenylthiourea {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 3-Methyl-1-pheny
Chemical Name Translation1-甲基-3-苯基硫脲
InChIKeyIGEQFPWPMCIYDF-UHFFFAOYSA-N
Wiswesser Line NotationSUYM1&MR
Beilstein Registry Number0638006
PubChem Substance ID698294
InChIInChI=1S/C8H10N2S/c1-9-8(11)10-7-5-3-2-4-6-7/h2-6H,1H3,(H2,9,10,11)
LabNetwork Molecule IDLN00158662
Canonical SMILESCNC(NC1=CC=CC=C1)=S
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分类

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

相关文献及参考

  • Short: III/35B Title: Nuclear Magnetic Resonance (NMR) Data: Chemical Shifts and Coupling Constants for Fluorine-19 and Nitrogen-15 Author: Balasubramanian, M.; Gupta, R.R.; Jain, M.; Perumal, S. Editor: Gupta, R.R.; Lechner, M.D. Source: Landolt-Börnstein, New Series Volume: III/35B Year: 1998 ISBN: 3-540-63275-1 ISBN: 978-3-540-63275-7 Internet Resource: DOI:10.1007/b55685 RefComment: VII, 242 pages. With CD-ROM. Hardcover Abstract: This volume provides a comprehensive and evaluated compilation of nuclear magnetic resonance data. Chemical shifts and coupling constants of boron-11 and phosphorus-31 (subvol. A), fluorine-19 and nitrogen-15 (subvol. B), hydrogen-1 (subvol. C), and carbon-13 (subvol. D) compounds are tabulated together with the gross- and structure formulas and the most readily available solvents. Due to the large amount of the data merely chemical shifts are presented in the printed versions, and all the data, chemical shifts and coupling constants are provided on CO-ROM's.

安全信息

Warnings IRRITANT
RTECSYT8750000 
TYPE OF TEST            : LDLo - Lowest published lethal dose
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : 50 mg/kg
TOXIC EFFECTS :
   Details of toxic effects not reported other than lethal dose value
REFERENCE :
   JPETAB Journal of Pharmacology and Experimental Therapeutics.  (Williams &
   Wilkins Co., 428 E. Preston St., Baltimore, MD 21202)  V.1-    1909/10-
   Volume(issue)/page/year: 93,287,1948

TYPE OF TEST            : Dominant lethal test
ROUTE OF EXPOSURE       : Intraperitoneal
TEST SYSTEM             : Rodent - mouse
DOSE/DURATION           : 50 mg/kg
REFERENCE :
   MGGEAE Molecular and General Genetics.  (Springer-Verlag, Heidelberger Pl.
   3, D-1000 Berlin 33, Fed. Rep. Ger.)  V.99-    1967-
   Volume(issue)/page/year: 117,197,1972

Storage condition

系列性分类

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