4'-Acetylbenzo-15-crown 5-Ether

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Names

[ CAS No. ]:
41757-95-3

[ Name ]:
4'-Acetylbenzo-15-crown 5-Ether

[Synonym ]:
1-(2,5,8,11,14-pentaoxabicyclo[13.4.0]nonadeca-1(15),16,18-trien-17-yl)ethanone
2,3-(4-Acetylbenzo)-1,4,7,10,13-pentaoxacyclopentadec-2-ene

Chemical & Physical Properties

[ Density]:
1.097g/cm3

[ Boiling Point ]:
481.1ºC at 760mmHg

[ Melting Point ]:
95-97ºC

[ Molecular Formula ]:
C16H22O6

[ Molecular Weight ]:
310.34200

[ Flash Point ]:
213.3ºC

[ Exact Mass ]:
310.14200

[ PSA ]:
63.22000

[ LogP ]:
1.71020

[ Index of Refraction ]:
1.474

MSDS

Click to get detail MSDS

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
KM5782540
CHEMICAL NAME :
Ethanone, 1-(2,3,5,6,8,9,11,12-octahydro-1,4,7,10,13-benzopenta oxacyclopentadecin-15 -yl)-
CAS REGISTRY NUMBER :
41757-95-3
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C16-H22-O6
MOLECULAR WEIGHT :
310.38

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 :
270 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
PCJOAU Pharmaceutical Chemistry Journal (English Translation). Translation of KHFZAN. (Plenum Pub. Corp., 233 Spring St., New York, NY 10013) No.1- 1967- Volume(issue)/page/year: 23,164,1989

Safety Information

[ RTECS ]:
KM5782540

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • benzo-15-crown-5
  • acetic acid
  • Ethanoic anhydride
  • Ethane,1,1'-oxybis[2-(2-chloroethoxy)-
  • 1-(3,4-Dihydroxyphenyl)ethanone
  • Acetyl chloride
  • 1,2-Benzenediol
  • Ms-PEG4-Ms
  • 2,2'-((Oxybis(ethane-2,1-diyl))bis(oxy))diethanol

DownStream

  • 4'-Methoxycarbonylbenzo-15-crown 5-Ether
  • (AMINOMETHYL)TRIMETHYLSILANE
  • 4-vinylbenzo-15-crown-5

Related Compounds

  • 4'-Methoxycarbonylbenzo-15-crown 5-Ether
  • 4'-bromobenzo-15-crown 5-ether
  • 4'-(1-Hydroxyethyl)-benzo-15-crown-5 ether
  • N-Phenylaza-15-crown 5-Ether
  • (AMINOMETHYL)TRIMETHYLSILANE
  • 4-vinylbenzo-15-crown-5
  • 4-((Cyclohexylamino)methyl)benzoic acid hydrochloride
  • 2-Chloro-5-fluoro-6-((4-methoxybenzyl)oxy)nicotinonitrile
  • 1-[(2,4-Dichlorophenyl)methyl]-N-(1,1-dimethylethyl)-2-methyl-1H-indole-3-methanamine
  • 2-Methoxy-6-(pyrazol-1-yl)-benzonitrile
  • (1s)-1-[6-(Dimethylamino)pyridin-3-yl]ethan-1-ol
  • 1H-3-Benzazepin-7-ol, 8-chloro-2,3,4,5-tetrahydro-5-(3-iodophenyl)-3-methyl-, (S)-
  • (4-Methyl-tetrahydro-furan-2-yl)-methanol
  • N-(1-cyanocyclopentyl)-2-[4-(4-fluorobenzenesulfonyl)-1,4-diazepan-1-yl]acetamide
  • 4,5,6,7-Tetrahydrobenzo[d]isoxazole-3-carbaldehyde
  • tert-Butyl-DL-alanine