1,4-Pentanedione,1-(3-furanyl)-

Suppliers

Names

[ CAS No. ]:
496-06-0

[ Name ]:
1,4-Pentanedione,1-(3-furanyl)-

[Synonym ]:
1-(furan-3-yl)pentane-1,4-dione

Chemical & Physical Properties

[ Density]:
1.104g/cm3

[ Boiling Point ]:
282ºC at 760mmHg

[ Molecular Formula ]:
C9H10O3

[ Molecular Weight ]:
166.17400

[ Flash Point ]:
127ºC

[ Exact Mass ]:
166.06300

[ PSA ]:
47.28000

[ LogP ]:
1.83150

[ Vapour Pressure ]:
0.00344mmHg at 25°C

[ Index of Refraction ]:
1.477

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
SA1956000
CHEMICAL NAME :
1,4-Pentanedione, 1-(3-furyl)-
CAS REGISTRY NUMBER :
496-06-0
BEILSTEIN REFERENCE NO. :
0125898
LAST UPDATED :
199612
DATA ITEMS CITED :
3
MOLECULAR FORMULA :
C9-H10-O3
MOLECULAR WEIGHT :
166.19
WISWESSER LINE NOTATION :
T5OJ CV2V1

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 :
26 mg/kg
TOXIC EFFECTS :
Vascular - other changes Lungs, Thorax, or Respiration - chronic pulmonary edema Lungs, Thorax, or Respiration - pleural effusion
REFERENCE :
BBACAQ Biochimica et Biophysica Acta. (Elsevier Science Pub. B.V., POB 211, 1000 AE Amsterdam, Netherlands) V.1- 1947- Volume(issue)/page/year: 337,184,1974
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
25 mg/kg
TOXIC EFFECTS :
Vascular - other changes Lungs, Thorax, or Respiration - chronic pulmonary edema Lungs, Thorax, or Respiration - pleural effusion
REFERENCE :
BBACAQ Biochimica et Biophysica Acta. (Elsevier Science Pub. B.V., POB 211, 1000 AE Amsterdam, Netherlands) V.1- 1947- Volume(issue)/page/year: 337,184,1974
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
14 mg/kg
TOXIC EFFECTS :
Vascular - other changes Lungs, Thorax, or Respiration - chronic pulmonary edema Lungs, Thorax, or Respiration - pleural effusion
REFERENCE :
BBACAQ Biochimica et Biophysica Acta. (Elsevier Science Pub. B.V., POB 211, 1000 AE Amsterdam, Netherlands) V.1- 1947- Volume(issue)/page/year: 337,184,1974

Safety Information

[ HS Code ]:
2932190090

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • Acetyl chloride
  • 3-Furoyl chloride
  • 3-Buten-2-one, 4-(tributylstannyl)-, (3E)
  • 3-[4,4-(ethylenedithio)pentanoyl]furan
  • (4R)-1-(furan-3-yl)-4,8-dimethylnonane-1,4,6-triol
  • 3-(2-methyl-[1,3]-dithiolan-2-yl)propionic acid
  • 1-[4,4-(ethylenedithio)pentanoyl]aziridine
  • 6,6-dimethoxy-1-(2-methyl-1,3-dithiolan-2-yl)-4-(phenylthio)hexan-3-one
  • 7,7-ethylenedithio-4-oxo-3-(phenylthio)octanal dimethyl acetal

DownStream

Customs

[ HS Code ]: 2932190090

[ Summary ]:
2932190090 other compounds containing an unfused furan ring (whether or not hydrogenated) in the structure VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:20.0%

Related Compounds

  • 1-(3-CHLORO-4-PYRIDYL)-1,4-PENTANEDIONE
  • 1,3-Diphenyl-2,4-pentanedione
  • 1-(4-{1-[3-(Cyclopentyloxy)-4-methoxyphenyl]-2-(4-pyridinyl)ethyl }phenyl)-3-ethylure
  • 3-Benzoyl-2,3-epoxy-1-phenyl-1,4-pentanedione
  • Piperazine, 1-(2-benzothiazolyl)-4-[[5-(5-methyl-2-furanyl)-2H-tetrazol-2-yl]acetyl]- (9CI)
  • ethyl 1-(3-nitrophenyl)-1,4-pentanedione-3-carboxylate