2-methyl-2-phenyl-1,3-oxathiolane

Modify Date: 2025-08-25 17:38:18

2-methyl-2-phenyl-1,3-oxathiolane Structure
2-methyl-2-phenyl-1,3-oxathiolane structure
Common Name 2-methyl-2-phenyl-1,3-oxathiolane
CAS Number 5684-32-2 Molecular Weight 180.26700
Density 1.113g/cm3 Boiling Point 288.1ºC at 760 mmHg
Molecular Formula C10H12OS Melting Point N/A
MSDS N/A Flash Point 128.1ºC

 Names

Name 2-methyl-2-phenyl-1,3-oxathiolane
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.113g/cm3
Boiling Point 288.1ºC at 760 mmHg
Molecular Formula C10H12OS
Molecular Weight 180.26700
Flash Point 128.1ºC
Exact Mass 180.06100
PSA 34.53000
LogP 2.62270
Index of Refraction 1.564
InChIKey IGPBFEYOHBVXTP-UHFFFAOYSA-N
SMILES CC1(c2ccccc2)OCCS1

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
RP5501000
CHEMICAL NAME :
1,3-Oxathiolane, 2-methyl-2-phenyl-
CAS REGISTRY NUMBER :
5684-32-2
BEILSTEIN REFERENCE NO. :
0125506
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C10-H12-O-S
MOLECULAR WEIGHT :
180.28
WISWESSER LINE NOTATION :
T5O CSTJ B1 BR

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
2 gm/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: 17,235,1982

 Synthetic Route

~99%

2-methyl-2-phenyl-1,3-oxathiolane Structure

2-methyl-2-phen...

CAS#:5684-32-2

Literature: Chauhan; Kumar, Anil; Sahoo Indian Journal of Chemistry - Section B Organic and Medicinal Chemistry, 2003 , vol. 42, # 10 p. 2635 - 2637

~43%

2-methyl-2-phenyl-1,3-oxathiolane Structure

2-methyl-2-phen...

CAS#:5684-32-2

Literature: Tanimoto, Shigeo; Jo, Shigeo; Sugimoto, Toyonari; Okano, Masaya Bulletin of the Chemical Society of Japan, 1981 , vol. 54, # 10 p. 3237 - 3238

 Synonyms

1,3-Oxathiolane,2-methyl-2-phenyl
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