1-hydroxy-2-[(3-iodophenyl)methylideneamino]guanidine; 4-methylbenzenesulfonic acid

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Names

[ CAS No. ]:
85894-20-8

[ Name ]:
1-hydroxy-2-[(3-iodophenyl)methylideneamino]guanidine; 4-methylbenzenesulfonic acid

[Synonym ]:
N-Hydroxy-2-((3-iodophenyl)methylene)hydrazinecarboximidamide tosylate
1-[(3iodobenzylidene)amino]-3-hydroxyguanidine tosylate
Hydrazinecarboximidamide,N-hydroxy-2-((3-iodophenyl)methylene)-,mono(4-methylbenzenesulfonate) (salt)

Chemical & Physical Properties

[ Boiling Point ]:
450.4ºC at 760 mmHg

[ Molecular Formula ]:
C15H17IN4O4S

[ Molecular Weight ]:
476.28900

[ Flash Point ]:
226.2ºC

[ Exact Mass ]:
476.00200

[ PSA ]:
145.75000

[ LogP ]:
4.33230

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
MV1696000
CHEMICAL NAME :
Hydrazinecarboximidamide, N-hydroxy-2-((3-iodophenyl)methylene)-, mono(4- methylbenzenesulfonate) (salt)
CAS REGISTRY NUMBER :
85894-20-8
LAST UPDATED :
198606
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C8-H9-I-N4-O.C7-H8-O3-S
MOLECULAR WEIGHT :
476.32

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 :
190 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
JMCMAR Journal of Medicinal Chemistry. (American Chemical Soc., Distribution Office Dept. 223, POB POB 57136, West End Stn., Washington, DC 20037) V.6- 1963- Volume(issue)/page/year: 27,236,1984

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • 3-Iodobenzaldehyde
  • S-methylisothiosemicarbazide tosylate
  • Methyl p-toluenesulfonate

DownStream

Related Compounds

  • 1H-Indole-2,3-dione, 1-[(3R)-3,4-dihydroxybutyl]-5-[[(2S)-2-(methoxymethyl)-1-pyrrolidinyl]sulfonyl]-
  • N-methyl-N-(oxan-4-yl)-1,2,3,4-tetrahydroisoquinoline-3-carboxamide hydrochloride
  • 3-O-Tert-butyl 7-O-methyl (1S,5R)-9-oxo-3-azabicyclo[3.3.1]nonane-3,7-dicarboxylate
  • Tert-butyl 4-(2-ethoxy-2-oxoethyl)-4-(pyrrolidin-1-YL)piperidine-1-carboxylate
  • 2-(Cyclohexyloxy)-4-(trifluoromethyl)phenol
  • 5-(2-Isopropylpyrimidin-4-YL)-4-methylthiazol-2-amine
  • methyl (1R,5S,7r)-3-azabicyclo[3.3.1]nonane-7-carboxylate
  • 2-imidazol-1-yl-3-(3,4,5-trimethoxyphenyl)sulfanyl-1H-indole
  • 1-{bicyclo[2.2.1]heptan-2-yl}-3-methyl-1H-pyrazol-5-amine
  • N-(2-methoxyethyl)-5,6,7,8-tetrahydroquinolin-8-amine