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135304-12-0

135304-12-0 structure
135304-12-0 structure
  • Name: Furo(3,2-b)furan, D-glucitol deriv.
  • Chemical Name: (6-nitrooxy-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-3-yl) 5-fluoropyridine-3-carboxylate
  • CAS Number: 135304-12-0
  • Molecular Formula: C12H11FN2O7
  • Molecular Weight: 314.22300
  • Create Date: 2016-02-05 05:01:20
  • Modify Date: 2024-01-14 17:58:02

Name (6-nitrooxy-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-3-yl) 5-fluoropyridine-3-carboxylate
Synonyms D-Glucitol,1,4:3,6-dianhydro-,2-(5-fluoro-3-pyridinecarboxylate) 5-nitrate
1,4:3,6-Dianhydrosorbitol-5-nitrate-2-(5-fluoronicotinate)
[(3S,3aR,6R,6aS)-6-nitrooxy-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-3-yl] 5-fluoropyridine-3-carboxylate
Density 1.56g/cm3
Boiling Point 442.9ºC at 760 mmHg
Molecular Formula C12H11FN2O7
Molecular Weight 314.22300
Flash Point 221.7ºC
Exact Mass 314.05500
PSA 112.70000
LogP 0.64380
Vapour Pressure 4.84E-08mmHg at 25°C
Index of Refraction 1.569

CHEMICAL IDENTIFICATION

RTECS NUMBER :
LZ4385400
CAS REGISTRY NUMBER :
135304-12-0
LAST UPDATED :
199212
DATA ITEMS CITED :
2
MOLECULAR FORMULA :
C12-H11-F-N2-O7
MOLECULAR WEIGHT :
314.25

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 :
2450 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
BCFAAI Bollettino Chimico Farmaceutico. (Societa Editoriale Farmaceutica, Via Ausonio 12, 20123 Milan, Italy) V.33- 1894- Volume(issue)/page/year: 128,74,1989
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
1440 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
BCFAAI Bollettino Chimico Farmaceutico. (Societa Editoriale Farmaceutica, Via Ausonio 12, 20123 Milan, Italy) V.33- 1894- Volume(issue)/page/year: 128,74,1989