4461-15-8

4461-15-8 structure
4461-15-8 structure
  • Name: 4-amino-3-(phenoxymethyl)-1H-1,2,4-triazole-5-thione
  • Chemical Name: 4-amino-3-(phenoxymethyl)-1H-1,2,4-triazole-5-thione
  • CAS Number: 4461-15-8
  • Molecular Formula: C9H10N4OS
  • Molecular Weight: 222.26700
  • Create Date: 2018-12-05 11:32:39
  • Modify Date: 2024-01-03 20:39:12

Name 4-amino-3-(phenoxymethyl)-1H-1,2,4-triazole-5-thione
Synonyms 2,4-Dihydro-4-amino-5-(phenoxymethyl)-3H-1,2,4-triazole-3-thione
4-amino-5-(phenoxymethyl)-4H-1,2,4-triazol-3-yl hydrosulfide
3H-1,2,4-Triazole-3-thione,2,4-dihydro-4-amino-5-(phenoxymethyl)
4-amino-5-(phenoxymethyl)-4H-1,2,4-triazole-3-thiol
3-phenoxymethyl-4-amino-5-mercapto-(4H)-1,2,4-triazole
4-amino-5-phenoxymethyl-2,4-dihydro-[1,2,4]triazole-3-thione
4-amino-5-(phenoxymethyl)-1,2,4-triazole-3-thiol
Density 1.45g/cm3
Boiling Point 361ºC at 760 mmHg
Molecular Formula C9H10N4OS
Molecular Weight 222.26700
Flash Point 172.1ºC
Exact Mass 222.05800
PSA 104.76000
LogP 1.44080
Index of Refraction 1.709

CHEMICAL IDENTIFICATION

RTECS NUMBER :
XZ5358570
CHEMICAL NAME :
3H-1,2,4-Triazole-3-thione, 2,4-dihydro-4-amino-5-(phenoxymethyl)-
CAS REGISTRY NUMBER :
4461-15-8
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C9-H10-N4-O-S
MOLECULAR WEIGHT :
222.29

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
>800 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
INDRBA Indian Drugs. (Indian Drugs Manufacturers' Assoc., 102B, Poonam Chambers, Dr. A. B. Rd., Worli, Bombay 400 018, India) V.1- 1963- Volume(issue)/page/year: 25,257,1988
HS Code 2933990090

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4461-15-8

Literature: Holla, B. Shivarama; Kalluraya, Balakrishna Indian Journal of Chemistry, Section B: Organic Chemistry Including Medicinal Chemistry, 1988 , vol. 27, # 1-12 p. 683 - 685

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4461-15-8 structure

4461-15-8

Literature: Husain, Asif; Naseer, Mohammad A.; Sarafroz, Mohammad Acta Poloniae Pharmaceutica - Drug Research, 2009 , vol. 66, # 2 p. 135 - 140

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4461-15-8 structure

4461-15-8

Literature: Husain, Asif; Naseer, Md. Arif Medicinal Chemistry Research, 2011 , vol. 20, # 1 p. 47 - 54

~61%

4461-15-8 structure

4461-15-8

Literature: Foroughifar, Naesr; Ebrahimi, Sattar; Mobinikhaledi, Akbar; Mozafari, Reza Heterocyclic Communications, 2011 , vol. 17, # 5-6 p. 211 - 214

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4461-15-8 structure

4461-15-8

Literature: Husain, Asif; Naseer, Md. Arif Medicinal Chemistry Research, 2011 , vol. 20, # 1 p. 47 - 54
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%