(3-alpha,4-alpha,6-beta)-Tetrahydro-4-(4-chlorophenyl)-6-methyl-3-phen yl-2H-pyran-2-one

Modify Date: 2025-09-18 16:57:55

(3-alpha,4-alpha,6-beta)-Tetrahydro-4-(4-chlorophenyl)-6-methyl-3-phen yl-2H-pyran-2-one structure	Common Name	(3-alpha,4-alpha,6-beta)-Tetrahydro-4-(4-chlorophenyl)-6-methyl-3-phen yl-2H-pyran-2-one
	CAS Number	75115-83-2	Molecular Weight	300.77900
	Density	1.182g/cm3	Boiling Point	451.2ºC at 760 mmHg
	Molecular Formula	C₁₈H₁₇ClO₂	Melting Point	N/A
	MSDS	N/A	Flash Point	241.1ºC

Name	(3S,4R,6R)-4-(4-chlorophenyl)-6-methyl-3-phenyloxan-2-one

Density	1.182g/cm3
Boiling Point	451.2ºC at 760 mmHg
Molecular Formula	C₁₈H₁₇ClO₂
Molecular Weight	300.77900
Flash Point	241.1ºC
Exact Mass	300.09200
PSA	26.30000
LogP	4.54280
Index of Refraction	1.568
InChIKey	QSAFSJAOPPHPTK-OAUYIBNBSA-N
SMILES	CC1CC(c2ccc(Cl)cc2)C(c2ccccc2)C(=O)O1

CHEMICAL IDENTIFICATION

RTECS NUMBER :: UQ1291000

CHEMICAL NAME :: 2H-Pyran-2-one, tetrahydro-4-(4-chlorophenyl)-6-methyl-3-phenyl-, (3-alpha,4-alpha,6-beta)-

CAS REGISTRY NUMBER :: 75115-83-2

LAST UPDATED :: 199503

DATA ITEMS CITED :: 1

MOLECULAR FORMULA :: C18-H17-Cl-O2

MOLECULAR WEIGHT :: 300.80

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :: LD - Lethal dose

ROUTE OF EXPOSURE :: Oral

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: >256 mg/kg

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

REFERENCE :: EJMCA5 European Journal of Medicinal Chemistry--Chimie Therapeutique. (Editions Scientifiques Elsevier, 29 rue Buffon, F-75005, Paris, France) V.9- 1974- Volume(issue)/page/year: 16,431,1981

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