539809-02-4
4-(2,4-DIMETHYLPHENYL)-5-(PHENOXYMETHYL)-2,4-DIHYDRO-3H-1,2,4-TRIAZOLE-3-THIONE
Name
4-(2,4-DIMETHYLPHENYL)-5-(PHENOXYMETHYL)-2,4-DIHYDRO-3H-1,2,4-TRIAZOLE-3-THIONE
Formula
C17 H17 N3 O S
MolWeight
311.407
1Identification
【Name】
4-(2,4-DIMETHYLPHENYL)-5-(PHENOXYMETHYL)-2,4-DIHYDRO-3H-1,2,4-TRIAZOLE-3-THIONE
【CAS】
【MDL】
MFCD05154899
【English Synonyms】
【Formula】
C17 H17 N3 O S
【MolWeight】
311.407
【Inchi】
InChI=1S/C17H17N3OS/c1-12-8-9-15(13(2)10-12)20-16(18-19-17(20)22)11-21-14-6-4-3-5-7-14/h3-10H,11H2,1-2H3,(H,19,22)
【InChIKey】
InChIKey=ZOGLRELNAWAHIZ-UHFFFAOYSA-N
【SMILES】
Cc1ccc(c(c1)C)n2c(n[nH]c2=S)COc3ccccc3
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:4
XLogP3:5.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
4-(2,4-DIMETHYLPHENYL)-5-(PHENOXYMETHYL)-2,4-DIHYDRO-3H-1,2,4-TRIAZOLE-3-THIONE.cml
Quick Release
1,3-DIMETHYL-5-[(1-METHYL-2-PYRROLIDINYLIDENE)ETHYLIDENE]-2-THIOXO-4-IMIDAZOLIDINONE
2445-60-5
5-ETHOXY-1,3-DIMETHYL-2-INDOLINONE
131042-86-9 ;131057-63-1
1,5-DIMETHYL-1H-INDOLE-2,3-DIONE
66440-60-6
5-AMINO-1-(2-FLUOROPHENYL)-1H-PYRAZOLE-4-CARBONITRILE
135108-48-4
1-(2-CHLOROPHENYL)-1H-PYRROLE-2,5-DIONE
1203-24-3
1-(2,4-DIMETHYL-PHENYL)-PYRROLE-2,5-DIONE
1080-52-0
TOP Suppliers
Sigma-Aldrich Corporation
Catalog No:L444316-10MG 10MG
Country/Region:United States
Business Type:Reagent Company
http://www.sigma-aldrich.com
More 539809-02-4 Suppliers>>
Catalog No:L444316-10MG 10MG
Country/Region:United States
Business Type:Reagent Company
http://www.sigma-aldrich.com
More 539809-02-4 Suppliers>>
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