577997-10-5
4-(((3-(4-F-PH)-5-MERCAPTO-4H-1,2,4-TRIAZOL-4-YL)IMINO)METHYL)BENZOIC ACID
Name
4-(((3-(4-F-PH)-5-MERCAPTO-4H-1,2,4-TRIAZOL-4-YL)IMINO)METHYL)BENZOIC ACID
Formula
C16 H11 F N4 O2 S
MolWeight
342.353
1Identification
【Name】
4-(((3-(4-F-PH)-5-MERCAPTO-4H-1,2,4-TRIAZOL-4-YL)IMINO)METHYL)BENZOIC ACID
【CAS】
【MDL】
MFCD04022576
【English Synonyms】
【Formula】
C16 H11 F N4 O2 S
【MolWeight】
342.353
【Inchi】
InChI=1S/C16H11FN4O2S/c17-13-7-5-11(6-8-13)14-19-20-16(24)21(14)18-9-10-1-3-12(4-2-10)15(22)23/h1-9H,(H,20,24)(H,22,23)/b18-9+
【InChIKey】
InChIKey=RFEPNBQYUDXYIE-GIJQJNRQSA-N
【SMILES】
c1cc(ccc1/C=N/n2c(nnc2S)c3ccc(cc3)F)C(=O)O
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:6
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
4-(((3-(4-F-PH)-5-MERCAPTO-4H-1,2,4-TRIAZOL-4-YL)IMINO)METHYL)BENZOIC ACID.cml
Quick Release
1-CYCLOOCTYL-1H-1,2,3,4-TETRAZOLE-5-THIOL
1-METHYL-5-(5-SULFANYL-1H-1,2,3,4-TETRAZOL-1-YL)PIPERIDIN-2-ONE
(1-CYCLOOCTYL-1H-1,2,3,4-TETRAZOL-5-YL)METHANAMINE
5-(CHLOROMETHYL)-1-CYCLOOCTYL-1H-1,2,3,4-TETRAZOLE
4-CYCLOOCTYL-3-SULFANYL-4,5-DIHYDRO-1H-1,2,4-TRIAZOL-5-ONE
DISUCCINIMIDYL SELENODIPROPIONATE
TOP Suppliers
Sigma-Aldrich Corporation
Catalog No:L409057-1EA 10MG
Country/Region:United States
Business Type:Reagent Company
http://www.sigma-aldrich.com
More 577997-10-5 Suppliers>>
Catalog No:L409057-1EA 10MG
Country/Region:United States
Business Type:Reagent Company
http://www.sigma-aldrich.com
More 577997-10-5 Suppliers>>
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(1-CYCLOOCTYL-1H-1,2,3,4-TETRAZOL-5-YL)METHANAMINE
5-(CHLOROMETHYL)-1-CYCLOOCTYL-1H-1,2,3,4-TETRAZOLE
4-CYCLOOCTYL-3-SULFANYL-4,5-DIHYDRO-1H-1,2,4-TRIAZOL-5-ONE
DISUCCINIMIDYL SELENODIPROPIONATE