1-benzyl-5-phenylsulfanyltriazole-4-carboxylic acid

Modify Date: 2025-10-10 00:42:59

1-benzyl-5-phenylsulfanyltriazole-4-carboxylic acid structure	Common Name	1-benzyl-5-phenylsulfanyltriazole-4-carboxylic acid
	CAS Number	84158-71-4	Molecular Weight	311.35800
	Density	N/A	Boiling Point	N/A
	Molecular Formula	C₁₆H₁₃N₃O₂S	Melting Point	N/A
	MSDS	N/A	Flash Point	N/A

Name	1-benzyl-5-phenylsulfanyltriazole-4-carboxylic acid

Molecular Formula	C₁₆H₁₃N₃O₂S
Molecular Weight	311.35800
Exact Mass	311.07300
PSA	93.31000
LogP	3.17580
InChIKey	HTPZOJIWZRBORC-UHFFFAOYSA-N
SMILES	O=C(O)c1nnn(Cc2ccccc2)c1Sc1ccccc1

ethyl 1-benzyl-...

CAS#:84158-70-3

~79%

1-benzyl-5-phen...

CAS#:84158-71-4

Literature: Buckle, Derek R.; Rockell, Caroline J. M.; Smith, Harry; Spicer, Barbara A. Journal of Medicinal Chemistry, 1984 , vol. 27, # 2 p. 223 - 227

ethyl 1-benzyl-...

CAS#:75020-50-7

1-benzyl-5-phen...

CAS#:84158-71-4

Literature: Buckle, Derek R.; Rockell, Caroline J. M.; Smith, Harry; Spicer, Barbara A. Journal of Medicinal Chemistry, 1984 , vol. 27, # 2 p. 223 - 227

Thiophenol

CAS#:108-98-5

1-benzyl-5-phen...

CAS#:84158-71-4

Literature: Buckle, Derek R.; Rockell, Caroline J. M.; Smith, Harry; Spicer, Barbara A. Journal of Medicinal Chemistry, 1984 , vol. 27, # 2 p. 223 - 227

Precursor 3
CAS#:84158-70-3 ethyl 1-benzyl-... CAS#:75020-50-7 ethyl 1-benzyl-... CAS#:108-98-5 Thiophenol
DownStream 1
CAS#:87598-59-2 1-benzyl-5-phen...

Names