5-(4-chlorophenyl)-1,2-dihydro-1,2,4-triazol-3-one

Modify Date: 2025-08-25 13:35:44

5-(4-chlorophenyl)-1,2-dihydro-1,2,4-triazol-3-one Structure
5-(4-chlorophenyl)-1,2-dihydro-1,2,4-triazol-3-one structure
Common Name 5-(4-chlorophenyl)-1,2-dihydro-1,2,4-triazol-3-one
CAS Number 33199-40-5 Molecular Weight 195.60600
Density 1.56g/cm3 Boiling Point N/A
Molecular Formula C8H6ClN3O Melting Point N/A
MSDS N/A Flash Point N/A

 Names

Name 5-(4-chlorophenyl)-1,2-dihydro-1,2,4-triazol-3-one
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.56g/cm3
Molecular Formula C8H6ClN3O
Molecular Weight 195.60600
Exact Mass 195.02000
PSA 61.54000
LogP 1.41840
Index of Refraction 1.711
InChIKey VBFJWKDMNDCDJN-UHFFFAOYSA-N
SMILES O=c1[nH]nc(-c2ccc(Cl)cc2)[nH]1

 Synthetic Route

~51%

5-(4-chlorophenyl)-1,2-dihydro-1,2,4-triazol-3-one Structure

5-(4-chlorophen...

CAS#:33199-40-5

Literature: Milcent, Rene; Nguyen, Thu-Huong Journal of Heterocyclic Chemistry, 1986 , vol. 23, # 3 p. 881 - 883

~6%

5-(4-chlorophenyl)-1,2-dihydro-1,2,4-triazol-3-one Structure

5-(4-chlorophen...

CAS#:33199-40-5

Literature: Ram, Ram N.; Varsha, Kiran Tetrahedron Letters, 1991 , vol. 32, # 41 p. 5829 - 5832

~75%

5-(4-chlorophenyl)-1,2-dihydro-1,2,4-triazol-3-one Structure

5-(4-chlorophen...

CAS#:33199-40-5

Literature: Alekseeva, V. Ya.; Boitkov, Yu. A.; Viktorovskii, I. V.; V'yunov, K. A. Chemistry of Heterocyclic Compounds (New York, NY, United States), 1986 , vol. 22, # 11 p. 1258 - 1261 Khimiya Geterotsiklicheskikh Soedinenii, 1986 , vol. 22, # 11 p. 1553 - 1556

 Precursor & DownStream

Precursor  2

DownStream  0

 Synonyms

5-<4-Chlor-phenyl>-2.4-dihydro-<1.2.4>triazol-3-on
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