[({4-[(4-{[(Amidinoamino)iminomethyl]amino}phenyl)sulfonyl]phenyl}amino)iminomethyl]aminocarboxamidine

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Names

[ CAS No. ]:
20566-97-6

[ Name ]:
[({4-[(4-{[(Amidinoamino)iminomethyl]amino}phenyl)sulfonyl]phenyl}amino)iminomethyl]aminocarboxamidine

[Synonym ]:
t-1211

Chemical & Physical Properties

[ Density]:
1.64g/cm3

[ Boiling Point ]:
782.4ºC at 760 mmHg

[ Molecular Formula ]:
C16H20N10O2S

[ Molecular Weight ]:
416.46100

[ Flash Point ]:
427ºC

[ Exact Mass ]:
416.14900

[ PSA ]:
238.08000

[ LogP ]:
3.98700

[ Vapour Pressure ]:
1.96E-24mmHg at 25°C

[ Index of Refraction ]:
1.765

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
DU2630000
CHEMICAL NAME :
Biguanide, 1,1'-(sulfonyldi-p-phenylene)bis-
CAS REGISTRY NUMBER :
20566-97-6
BEILSTEIN REFERENCE NO. :
2194619
LAST UPDATED :
199612
DATA ITEMS CITED :
2
MOLECULAR FORMULA :
C16-H20-N10-O2-S
MOLECULAR WEIGHT :
416.52
WISWESSER LINE NOTATION :
MUYZMYUM&MR DSWR DMYUM&MYZUM

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 :
1250 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
APPFAR Acta Poloniae Pharmaceutica (English Translation). Translation of APPHAX. (Warsaw, Poland) V.20-29, 1963-72. Discontinued. Volume(issue)/page/year: 26,487,1969
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
102 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
APPFAR Acta Poloniae Pharmaceutica (English Translation). Translation of APPHAX. (Warsaw, Poland) V.20-29, 1963-72. Discontinued. Volume(issue)/page/year: 26,487,1969

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • 4,4'-Diaminodiphenylsulfone

DownStream

Related Compounds

  • 2-Oxo-1',2',5',6',7',7a'-hexahydrospiro[indoline-3,3'-pyrrolizine]-2'-carboxylic acid
  • 4-(3,4-dimethylphenyl)-1H-benzo[b][1,4]diazepin-2(3H)-one
  • 4-(thiophen-2-yl)-1H-benzo[b][1,4]diazepin-2(3H)-one
  • 2-Ethyl-4-methylpyrimidine-5-carboxylic acid
  • 1-Phenyl-5-(pyridin-2-yl)-1H-1,2,3-triazole-4-carboxylic acid
  • 1-(2-fluorophenyl)-5-(methoxymethyl)-1H-1,2,3-triazole-4-carboxylic acid
  • 2'-cyclohexyl-1'-oxo-1',4'-dihydro-2'H-spiro[cyclopentane-1,3'-isoquinoline]-4'-carboxylic acid
  • 7-amino-2-ethyl-4-[(2-fluorophenyl)methyl]-3,4-dihydro-2H-1,4-benzoxazin-3-one
  • 7-amino-2-ethyl-4-[(4-fluorophenyl)methyl]-3,4-dihydro-2H-1,4-benzoxazin-3-one
  • 6-amino-2-ethyl-4-[(2-fluorophenyl)methyl]-3,4-dihydro-2H-1,4-benzoxazin-3-one
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