741731-80-6
([4-ETHYL-5-(2-METHYLPHENYL)-4H-1,2,4-TRIAZOL-3-YL]THIO)ACETIC ACID
Name
([4-ETHYL-5-(2-METHYLPHENYL)-4H-1,2,4-TRIAZOL-3-YL]THIO)ACETIC ACID
Formula
C13 H15 N3 O2 S
MolWeight
277.346
1Identification
【Name】
([4-ETHYL-5-(2-METHYLPHENYL)-4H-1,2,4-TRIAZOL-3-YL]THIO)ACETIC ACID
【CAS】
【MDL】
MFCD03429376
【English Synonyms】
【Formula】
C13 H15 N3 O2 S
【MolWeight】
277.346
【Inchi】
InChI=1S/C13H15N3O2S/c1-3-16-12(10-7-5-4-6-9(10)2)14-15-13(16)19-8-11(17)18/h4-7H,3,8H2,1-2H3,(H,17,18)
【InChIKey】
InChIKey=FUJOXKPOSMNFOS-UHFFFAOYSA-N
【SMILES】
CCn1c(nnc1SCC(=O)O)c2ccccc2C
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:5
XLogP3:0.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
([4-ETHYL-5-(2-METHYLPHENYL)-4H-1,2,4-TRIAZOL-3-YL]THIO)ACETIC ACID.cml
Quick Release
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Catalog No:EN300-07984 10G
Catalog No:EN300-07984 5G
Catalog No:EN300-07984 1G
Catalog No:EN300-07984 50G
Catalog No:EN300-07984 2.5G
Catalog No:EN300-07984 25G
Country/Region:Ukraine
Business Type:Trading Company
http://www.enamine.net
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