ethyl (2E)-2-[5-(4-bromophenyl)-3-oxofuran-2-ylidene]acetate

Names

[ CAS No. ]:
97181-05-0

[ Name ]:
ethyl (2E)-2-[5-(4-bromophenyl)-3-oxofuran-2-ylidene]acetate

[Synonym ]:
Ethyl (5-(4-bromophenyl)-3-oxo-2(3H)-furanylidene)acetate
Acetic acid,(5-(4-bromophenyl)-3-oxo-2(3H)-furanylidene)-,ethyl ester

Chemical & Physical Properties

[ Density]:
1.602g/cm3

[ Boiling Point ]:
473.3ºC at 760 mmHg

[ Molecular Formula ]:
C14H11BrO4

[ Molecular Weight ]:
323.13900

[ Flash Point ]:
240ºC

[ Exact Mass ]:
321.98400

[ PSA ]:
52.60000

[ LogP ]:
2.83630

[ Index of Refraction ]:
1.653

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
AF6360000
CHEMICAL NAME :
Acetic acid, (5-(4-bromophenyl)-3-oxo-2(3H)-furanylidene)-, ethyl ester
CAS REGISTRY NUMBER :
97181-05-0
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C14-H11-Br-O4
MOLECULAR WEIGHT :
323.16

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 :
>600 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: 25,891,1991

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • Ethyl 2-(triphenylphosphoranylidene)acetate
  • 5-(4-bromophenyl)furan-2,3-dione

DownStream

Related Compounds

  • Methyl 2-(methylamino)-2-(3,4,5-trifluorophenyl)acetate
  • 4-(4-Isobutylpiperazin-1-yl)-3-(trifluoromethyl)aniline
  • 7-Chloro-2-methoxy-2,3-dihydro-benzofuran-4-carboxylic acid ethyl ester
  • 5-(3,4,5-Trifluorophenyl)isoxazole-3-carboxylic acid
  • 2-hydroxy-2-(1H-1,2,4-triazol-3-yl)acetic acid
  • 3-allyloxy-4-fluoro-benzoic Acid Ethyl Ester
  • 2-Dimethylamino-5-m-tolyl-thiazole-4-carboxylic Acid
  • 5-Fluoro-2-(2-methoxyphenoxy)-1-nitrobenzene
  • 2,3-dihydro-1H-indole-4-carboxamide
  • 2-Bromo-6-(2-nitroethenyl)phenol
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