(4-Methylphenyl)(3-(beta-D-xylopyranosyloxy)phenyl)methanone

Modify Date: 2024-01-27 17:36:24

(4-Methylphenyl)(3-(beta-D-xylopyranosyloxy)phenyl)methanone structure	Common Name	(4-Methylphenyl)(3-(beta-D-xylopyranosyloxy)phenyl)methanone
	CAS Number	83355-08-2	Molecular Weight	344.35900
	Density	1.364g/cm3	Boiling Point	587.7ºC at 760 mmHg
	Molecular Formula	C₁₉H₂₀O₆	Melting Point	N/A
	MSDS	N/A	Flash Point	213.4ºC

Name	(4-methylphenyl)-[3-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyphenyl]methanone

Density	1.364g/cm3
Boiling Point	587.7ºC at 760 mmHg
Molecular Formula	C₁₉H₂₀O₆
Molecular Weight	344.35900
Flash Point	213.4ºC
Exact Mass	344.12600
PSA	96.22000
LogP	1.04380
Index of Refraction	1.635
InChIKey	NHAGOPRLXYGJDT-LULLPPNCSA-N
SMILES	Cc1ccc(C(=O)c2cccc(OC3OCC(O)C(O)C3O)c2)cc1

CHEMICAL IDENTIFICATION

RTECS NUMBER :: PC4965610

CHEMICAL NAME :: Methanone, (4-methylphenyl)(3-(beta-D-xylopyranosyloxy)phenyl)-

CAS REGISTRY NUMBER :: 83355-08-2

LAST UPDATED :: 199409

DATA ITEMS CITED :: 1

MOLECULAR FORMULA :: C19-H20-O6

MOLECULAR WEIGHT :: 344.39

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :: LD - Lethal dose

ROUTE OF EXPOSURE :: Intraperitoneal

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: >800 mg/kg

TOXIC EFFECTS :: Details of toxic effects not reported other than lethal dose value

REFERENCE :: JMCMAR Journal of Medicinal Chemistry. (American Chemical Soc., Distribution Office Dept. 223, POB POB 57136, West End Stn., Washington, DC 20037) V.6- 1963- Volume(issue)/page/year: 36,898,1993

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