4,5-Pyrimidinediamine, 6-chloro-N4- (2-phenylethyl)-

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Names

[ CAS No. ]:
73840-54-7

[ Name ]:
4,5-Pyrimidinediamine, 6-chloro-N4- (2-phenylethyl)-

[Synonym ]:
6-Chloro-N4-phenethyl-pyrimidine-4,5-diamine
5-amino-6-chloro-4-phenethylaminopyrimidine

Chemical & Physical Properties

[ Density]:
1.331g/cm3

[ Boiling Point ]:
459.5ºC at 760 mmHg

[ Molecular Formula ]:
C12H13ClN4

[ Molecular Weight ]:
248.71100

[ Flash Point ]:
231.7ºC

[ Exact Mass ]:
248.08300

[ PSA ]:
63.83000

[ LogP ]:
3.02100

[ Index of Refraction ]:
1.676

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
UV6350000
CHEMICAL NAME :
Pyrimidine, 5-amino-6-chloro-4-(phenethylamino)-
CAS REGISTRY NUMBER :
73840-54-7
LAST UPDATED :
197902
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C12-H13-Cl-N4
MOLECULAR WEIGHT :
248.74
WISWESSER LINE NOTATION :
T6N CNJ DM2R& EZ FG

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
11 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
CSLNX* U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. (Aberdeen Proving Ground, MD 21010) Volume(issue)/page/year: NX#04517

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • 4,6-Dichloro-5-pyrimidinamine
  • 2-Phenylethanamine

DownStream

  • 6H-Purin-6-one,1,9-dihydro-9-(2-phenylethyl)-

Related Compounds

  • Benzenesulfonamide,4-chloro-n-[1-(2,3-dihydro-1h-indol-7-yl)-2-oxocyclohexyl]-
  • 5-(Pyrrolidin-1-ylmethyl)furan-2-carbaldehyde
  • 2-[(6-Methyl-pyridin-2-ylmethyl)-amino]-ethanol
  • {2,6-dimethyl-4-[(4-methylphenyl)amino]-3,4-dihydroquinolin-1(2H)-yl}(furan-2-yl)methanone
  • 3-(2-methoxyphenyl)-2,8,8-trimethyl-8,9-dihydropyrazolo[5,1-c][1,2,4]benzotriazin-6(7H)-one
  • 2-[4-(2-fluorophenyl)piperazin-1-yl]-7-(2-hydroxyphenyl)-4-methyl-7,8-dihydroquinazolin-5(6H)-one
  • 4-{[4-(3-Chlorophenyl)piperazinyl]methyl}-6-morpholin-4-yl-1,3,5-triazine-2-yl amine
  • 1-(2,5-dimethoxyphenyl)-5-oxo-N-(1,3-thiazol-2-yl)pyrrolidine-3-carboxamide
  • 5-(3-Bromopropyl)-3-methyl-1,2-oxazole
  • N-{5-[1-(4-ethylphenyl)-5-oxopyrrolidin-3-yl]-1,3,4-thiadiazol-2-yl}-2,2-dimethylpropanamide
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