4-(4-chlorophenyl)-6-methyl-3-phenyl-oxan-2-one

Modify Date: 2025-08-26 19:09:30

4-(4-chlorophenyl)-6-methyl-3-phenyl-oxan-2-one Structure
4-(4-chlorophenyl)-6-methyl-3-phenyl-oxan-2-one structure
Common Name 4-(4-chlorophenyl)-6-methyl-3-phenyl-oxan-2-one
CAS Number 75115-73-0 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

 Names

Name 4-(4-chlorophenyl)-6-methyl-3-phenyloxan-2-one
Synonym More Synonyms

 Chemical & Physical Properties

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-QMEQOSATSA-N
SMILES CC1CC(c2ccc(Cl)cc2)C(c2ccccc2)C(=O)O1

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
UQ1292000
CHEMICAL NAME :
2H-Pyran-2-one, tetrahydro-4-(4-chlorophenyl)-6-methyl-3-phenyl-, (3-alpha,4-beta,6-alpha)-
CAS REGISTRY NUMBER :
75115-73-0
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

 Synonyms

4-CHLORO-5-METHOXYBENZOFURAN
chloro-4 methoxy-5 benzofuranne
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