2-[4-(4-chloro-phenylsulfanyl)-3,5-dimethyl-phenyl]-3,5-dioxo-2,3,4,5-tetrahydro-[1,2,4]triazine-6-carboxylic acid

Modify Date: 2025-09-23 11:05:00

2-[4-(4-chloro-phenylsulfanyl)-3,5-dimethyl-phenyl]-3,5-dioxo-2,3,4,5-tetrahydro-[1,2,4]triazine-6-carboxylic acid Structure
2-[4-(4-chloro-phenylsulfanyl)-3,5-dimethyl-phenyl]-3,5-dioxo-2,3,4,5-tetrahydro-[1,2,4]triazine-6-carboxylic acid structure
Common Name 2-[4-(4-chloro-phenylsulfanyl)-3,5-dimethyl-phenyl]-3,5-dioxo-2,3,4,5-tetrahydro-[1,2,4]triazine-6-carboxylic acid
CAS Number 409127-31-7 Molecular Weight 403.83900
Density N/A Boiling Point N/A
Molecular Formula C18H14ClN3O4S Melting Point N/A
MSDS N/A Flash Point N/A

 Names

Name 2-[4-(4-chloro-phenylsulfanyl)-3,5-dimethyl-phenyl]-3,5-dioxo-2,3,4,5-tetrahydro-[1,2,4]triazine-6-carboxylic acid

 Chemical & Physical Properties

Molecular Formula C18H14ClN3O4S
Molecular Weight 403.83900
Exact Mass 403.03900
PSA 130.35000
LogP 3.04040
InChIKey HFKWNDHBOIIUBJ-UHFFFAOYSA-N
SMILES COC(=O)c1c(Cl)cc(C(N)=O)cc1Cl

 Precursor & DownStream

Precursor  0

DownStream  2

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