6-chloro-9-(4-methoxyphenyl)purine

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Names

[ CAS No. ]:
21313-95-1

[ Name ]:
6-chloro-9-(4-methoxyphenyl)purine

Chemical & Physical Properties

[ Density]:
1.44g/cm3

[ Boiling Point ]:
448.2ºC at 760 mmHg

[ Molecular Formula ]:
C12H9ClN4O

[ Molecular Weight ]:
260.67900

[ Flash Point ]:
224.8ºC

[ Exact Mass ]:
260.04600

[ PSA ]:
52.83000

[ LogP ]:
2.47750

[ Vapour Pressure ]:
3.17E-08mmHg at 25°C

[ Index of Refraction ]:
1.693

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
UO7520300
CHEMICAL NAME :
Purine, 6-chloro-9-(p-methoxyphenyl)-
CAS REGISTRY NUMBER :
21313-95-1
BEILSTEIN REFERENCE NO. :
2986456
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C12-H9-Cl-N4-O
MOLECULAR WEIGHT :
260.70
WISWESSER LINE NOTATION :
T56 BN DN FN HNJ DR DO1& IG

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 :
32 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#04516

Safety Information

[ HS Code ]:
2933990090

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • 4-Methoxyphenylboronic acid
  • 6-chloropurine
  • 6H-Purin-6-one,1,9-dihydro-9-(4-methoxyphenyl)-
  • 5-amino-1-(4-methoxyphenyl)imidazole-4-carboxamide

DownStream

Customs

[ 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%

Related Compounds

  • 6-chloro-9-[(4-methoxyphenyl)methyl]purine
  • 6-chloro-9-(4-methoxyphenyl)-2-methylpurine
  • 6-chloro-9-(4-chlorobutyl)purine
  • 6-chloro-9-(4-methylphenyl)purine
  • 6-chloro-9-(4-methoxybenzyl)-9H-purine
  • 6-chloro-9-[(4-chlorophenyl)methyl]-9H-purine
  • 4-((Cyclohexylamino)methyl)benzoic acid hydrochloride
  • 1-[(2,4-Dichlorophenyl)methyl]-N-(1,1-dimethylethyl)-2-methyl-1H-indole-3-methanamine
  • 2-Methoxy-6-(pyrazol-1-yl)-benzonitrile
  • 2-{1-[2-(2-Methoxyphenyl)acetyl]azetidin-3-yl}-6-phenyl-2,3-dihydropyridazin-3-one
  • 1H-3-Benzazepin-7-ol, 8-chloro-2,3,4,5-tetrahydro-5-(3-iodophenyl)-3-methyl-, (S)-
  • 1-cyclobutyl-4-(2,3-dihydrobenzofuran-5-ylsulfonyl)-1,4-diazepane
  • (4-Methyl-tetrahydro-furan-2-yl)-methanol
  • 2-(1-((5-chlorothiophen-2-yl)sulfonyl)azetidin-3-yl)-2H-1,2,3-triazole
  • N-(1-cyanocyclopentyl)-2-[4-(4-fluorobenzenesulfonyl)-1,4-diazepan-1-yl]acetamide
  • 4,5,6,7-Tetrahydrobenzo[d]isoxazole-3-carbaldehyde