(Z)-2,3-Dihydro-3-(1,3-benzodioxol-5-ylmethylene)-6-methoxy-4H-1-benzo thiopyran-4-one

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Names

[ CAS No. ]:
130689-05-3

[ Name ]:
(Z)-2,3-Dihydro-3-(1,3-benzodioxol-5-ylmethylene)-6-methoxy-4H-1-benzo thiopyran-4-one

Chemical & Physical Properties

[ Density]:
1.387g/cm3

[ Boiling Point ]:
539.5ºC at 760mmHg

[ Molecular Formula ]:
C18H14O4S

[ Molecular Weight ]:
326.36600

[ Flash Point ]:
282.6ºC

[ Exact Mass ]:
326.06100

[ PSA ]:
70.06000

[ LogP ]:
3.79590

[ Vapour Pressure ]:
1.05E-11mmHg at 25°C

[ Index of Refraction ]:
1.693

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
DM0014400
CHEMICAL NAME :
4H-1-Benzothiopyran-4-one, 2,3-dihydro-3-(1,3-benzodioxol-5-ylmethylene)-6-metho xy-, (Z)-
CAS REGISTRY NUMBER :
130689-05-3
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C18-H14-O4-S
MOLECULAR WEIGHT :
326.38

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD10 - Lethal Dose
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
248 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
DCTODJ Drug and Chemical Toxicology. (Marcel Dekker, 270 Madison Ave., New York, NY 10016) V.1- 1977/78- Volume(issue)/page/year: 13,195,1990

Related Compounds

  • 3-[(2-Fluoropyridin-3-yl)methyl]azetidin-3-ol
  • rac-tert-butyl (1R,6R)-1-hydroxy-3-azabicyclo[4.1.0]heptane-3-carboxylate
  • tert-butyl N-ethyl-N-[(2R)-2-hydroxybutyl]carbamate
  • tert-butyl N-[3-(1-hydroxy-2-methoxyethyl)phenyl]carbamate
  • tert-butyl N-[3-(4-bromophenyl)-3-hydroxypropyl]-N-methylcarbamate
  • tert-butyl N-[(1-benzyl-3-hydroxypyrrolidin-3-yl)methyl]-N-methylcarbamate
  • Methyl 4-(oxan-4-yl)pyrrolidine-3-carboxylate hydrochloride
  • tert-butyl 4-[hydroxy(1-methyl-1H-pyrazol-5-yl)methyl]piperidine-1-carboxylate
  • tert-butyl N-[2-hydroxy-2-(1-methyl-1H-pyrazol-5-yl)ethyl]-N-methylcarbamate
  • 1-[3-(Azidomethyl)-5-iodophenyl]piperazine
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