4-amino-3-[(2,4-dichlorophenoxy)methyl]-1H-1,2,4-triazole-5-thione

Modify Date: 2025-09-16 18:53:59

4-amino-3-[(2,4-dichlorophenoxy)methyl]-1H-1,2,4-triazole-5-thione Structure
4-amino-3-[(2,4-dichlorophenoxy)methyl]-1H-1,2,4-triazole-5-thione structure
Common Name 4-amino-3-[(2,4-dichlorophenoxy)methyl]-1H-1,2,4-triazole-5-thione
CAS Number 4413-40-5 Molecular Weight 291.15700
Density 1.69g/cm3 Boiling Point 419.9ºC at 760 mmHg
Molecular Formula C9H8Cl2N4OS Melting Point N/A
MSDS N/A Flash Point 207.7ºC

 Names

Name 4-amino-3-[(2,4-dichlorophenoxy)methyl]-1H-1,2,4-triazole-5-thione

 Chemical & Physical Properties

Density 1.69g/cm3
Boiling Point 419.9ºC at 760 mmHg
Molecular Formula C9H8Cl2N4OS
Molecular Weight 291.15700
Flash Point 207.7ºC
Exact Mass 289.98000
PSA 104.76000
LogP 2.74760
Index of Refraction 1.736
InChIKey QESGKBGZPADFHW-UHFFFAOYSA-N
SMILES Nn1c(COc2ccc(Cl)cc2Cl)n[nH]c1=S

 Safety Information

HS Code 2933990090

 Synthetic Route

~%

4-amino-3-[(2,4-dichlorophenoxy)methyl]-1H-1,2,4-triazole-5-thione Structure

4-amino-3-[(2,4...

CAS#:4413-40-5

Literature: Subrahmanya Bhat; Jagadeesh Prasad; Poojary, Boja; Shivarama Holla Phosphorus, Sulfur and Silicon and the Related Elements, 2004 , vol. 179, # 8 p. 1595 - 1603 Title/Abstract Full Text View citing articles Show Details Shivarama Holla; Sooryanarayana Rao; Sarojini; Akberali; Suchetha Kumari European Journal of Medicinal Chemistry, 2006 , vol. 41, # 5 p. 657 - 663

 Precursor & DownStream

Precursor  2

DownStream  0

 Customs

HS Code 2933990090
Summary 2933990090. heterocyclic compounds with nitrogen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%
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