5-(4-BROMO-PHENYL)-4H-[1,2,4]TRIAZOLE-3-THIOL

Modify Date: 2026-07-06 06:47:18

5-(4-BROMO-PHENYL)-4H-[1,2,4]TRIAZOLE-3-THIOL Structure
5-(4-BROMO-PHENYL)-4H-[1,2,4]TRIAZOLE-3-THIOL structure
Common Name 5-(4-BROMO-PHENYL)-4H-[1,2,4]TRIAZOLE-3-THIOL
CAS Number 39631-33-9 Molecular Weight 256.12200
Density 1.83g/cm3 Boiling Point 314.6ºC at 760 mmHg
Molecular Formula C8H6BrN3S Melting Point N/A
MSDS N/A Flash Point 144.1ºC

 Names

Name 5-(4-bromophenyl)-1,2-dihydro-1,2,4-triazole-3-thione
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.83g/cm3
Boiling Point 314.6ºC at 760 mmHg
Molecular Formula C8H6BrN3S
Molecular Weight 256.12200
Flash Point 144.1ºC
Exact Mass 254.94700
PSA 76.56000
LogP 2.89680
Index of Refraction 1.775
InChIKey XWHAVZKPVJXNCK-UHFFFAOYSA-N
SMILES S=c1nc(-c2ccc(Br)cc2)[nH][nH]1

 Safety Information

HS Code 2933990090

 Synthetic Route

~67%

5-(4-BROMO-PHENYL)-4H-[1,2,4]TRIAZOLE-3-THIOL Structure

5-(4-BROMO-PHEN...

CAS#:39631-33-9

Learn More
Literature: Narayan, Sat; Handa, R. N.; Pujari, H. K. Indian Journal of Chemistry, Section B: Organic Chemistry Including Medicinal Chemistry, 1985 , vol. 24, p. 1221 - 1223

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5-(4-BROMO-PHENYL)-4H-[1,2,4]TRIAZOLE-3-THIOL Structure

5-(4-BROMO-PHEN...

CAS#:39631-33-9

Learn More
Literature: Chao, Shu-Jun; Geng, Ming-Jiang; Wang, Ying-Ling Journal of the Korean Chemical Society, 2010 , vol. 54, # 6 p. 731 - 736

 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%

 Bioassay

View more

Name: Inhibition of Rickettsia prowazekii N-terminal His6-tagged methionine aminopeptidase ...
Source: ChEMBL
Target: N/A
External Id: CHEMBL4121205
Name: High Throughput Screening of small molecules that kill Mycobacterium tuberculosis
Source: 15607
Target: N/A
External Id: Cornell_MTB_2017
Name: Cell-based high throughput primary assay to identify activators of GPR151
Source: The Scripps Research Institute Molecular Screening Center
Target: RecName: Full=G-protein coupled receptor 151; AltName: Full=G-protein coupled receptor PGR7; AltName: Full=GPCR-2037; AltName: Full=Galanin receptor 4; AltName: Full=Galanin-receptor-like protein; Short=GalRL
External Id: GPR151_PHUNTER_AG_LUMI_1536_1X%ACT
Name: AlphaScreen-based biochemical high throughput primary assay to identify activators of...
Source: The Scripps Research Institute Molecular Screening Center
Target: N/A
External Id: FBW7_ACT_ALPHA_1536_1X%ACT PRUN
Name: AlphaScreen-based biochemical high throughput primary assay to identify inhibitors of...
Source: The Scripps Research Institute Molecular Screening Center
External Id: MITF_INH_Alpha_1536_1X%INH PRUN
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 Synonyms

5-(4-Bromo-phenyl)-4H-[1,2,4]triazole-3-thiol
3-(p-Bromophenyl)-5-mercapto-s-triazole
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