2-(4-Phenyl-5-(2-propenylthio)-4H-1,2,4-triazol-3-yl)phenol

Modify Date: 2024-01-29 11:45:50

2-(4-Phenyl-5-(2-propenylthio)-4H-1,2,4-triazol-3-yl)phenol Structure
2-(4-Phenyl-5-(2-propenylthio)-4H-1,2,4-triazol-3-yl)phenol structure
 Common Name 2-(4-Phenyl-5-(2-propenylthio)-4H-1,2,4-triazol-3-yl)phenol
CAS Number 81518-35-6 Molecular Weight 309.38600
Density 1.22g/cm3 Boiling Point 443.4ºC at 760 mmHg
Molecular Formula C17H15N3OS Melting Point N/A
MSDS N/A Flash Point 221.9ºC

 Names

Name 2-(4-Phenyl-5-(2-propenylthio)-4H-1,2,4-triazol-3-yl)phenol

 Chemical & Physical Properties

Density 1.22g/cm3
Boiling Point 443.4ºC at 760 mmHg
Molecular Formula C17H15N3OS
Molecular Weight 309.38600
Flash Point 221.9ºC
Exact Mass 309.09400
PSA 76.24000
LogP 3.91800
Index of Refraction 1.649

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
SM8339500
CHEMICAL NAME :
Phenol, 2-(4-phenyl-5-(2-propenylthio)-4H-1,2,4-triazol-3-yl) -
CAS REGISTRY NUMBER :
81518-35-6
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C17-H15-N3-O-S
MOLECULAR WEIGHT :
309.41

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
>1 gm/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
IJSBDB Indian Journal of Chemistry, Section B: Organic Chemistry, Including Medicinal Chemistry. (Publications & Information Directorate, Council of Scientific and Industrial Research (CSIR), Hillside Rd., New Delhi 110 012, India) V.14B- 1976- Volume(issue)/page/year: 20,1017,1981

 Synthetic Route

4-phenyl-5-(2'-hydroxyphenyl)-3-mercapto-1,2,4-triazole structure

4-phenyl-5-(2'-...

CAS#:81518-26-5

~86%

2-(4-Phenyl-5-(2-propenylthio)-4H-1,2,4-triazol-3-yl)phenol Structure

2-(4-Phenyl-5-(...

CAS#:81518-35-6

Literature: Tandon, M.; Barthwal, J. P.; Bhalla, T. N.; Bhargava, K. P. Indian Journal of Chemistry, Section B: Organic Chemistry Including Medicinal Chemistry, 1981 , vol. 20, # 11 p. 1017 - 1018
4-phenyl-1-(2-hydroxybenzoyl)thiosemicarbazide structure

4-phenyl-1-(2-h...

CAS#:37536-32-6

~%

2-(4-Phenyl-5-(2-propenylthio)-4H-1,2,4-triazol-3-yl)phenol Structure

2-(4-Phenyl-5-(...

CAS#:81518-35-6

Literature: Tandon, M.; Barthwal, J. P.; Bhalla, T. N.; Bhargava, K. P. Indian Journal of Chemistry, Section B: Organic Chemistry Including Medicinal Chemistry, 1981 , vol. 20, # 11 p. 1017 - 1018

 Precursor & DownStream

Precursor  2

DownStream  0

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Chemsrc provides CAS#:81518-35-6 MSDS, density, melting point, boiling point, structure, etc. Its name is 2-(4-Phenyl-5-(2-propenylthio)-4H-1,2,4-triazol-3-yl)phenol>> amp version: 2-(4-Phenyl-5-(2-propenylthio)-4H-1,2,4-triazol-3-yl)phenol

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