ChemicalBook--->CAS DataBase List--->68505-69-1

68505-69-1

68505-69-1 Structure

68505-69-1 Structure
IdentificationBack Directory
[Name]

BENFURESATE
[CAS]

68505-69-1
[Synonyms]

NS 112
Zerbex
nc20484
CYPERAL
Morlene
BENFURESATE
Benfuresate 0
Einecs 270-925-4
Benfuresate [iso]
BENFURESATE STANDARD
Benfuresate Solution, 100ppm
Benfuresate Reference Material
Benfuresate@100 μg/mL in Methanol
Benfuresate@1000 μg/mL in Acetonitrile
Benfuresate Solution in Methanol, 100μg/mL
5-ethylsulfonyloxy-3,3-dimethyl-2H-benzofuran
benfuresate (bsi,draft e-iso,(m) draft f-iso)
2,3-dihydro-3,3-dimethyl-5-benzofurylethanesulphonate
2,3-Dihydro-3,3-dimethyl-5-benzofuranylethanesulfonate
2,3-Dihydro-3,3-dimethyl-5-benzofuranyl ethanesulphonate
ethanesulfonicacid,2,3-dihydro-3,3-dimethyl-5-benzofuranylester
Ethanesulfonic acid 2,3-dihydro-3,3-dimethylbenzofuran-5-yl ester
Ethanesulfonic acid=3,3-dimethyl-2,3-dihydrobenzofuran-5-yl ester
Ethanesulfonic acid 2,3-dihydro-3,3-dimethylbenzo[b]furan-5-yl ester
[EINECS(EC#)]

270-925-4
[Molecular Formula]

C12H16O4S
[MDL Number]

MFCD01728672
[MOL File]

68505-69-1.mol
[Molecular Weight]

256.32
Chemical PropertiesBack Directory
[Melting point ]

30.1 °C
[Boiling point ]

386.5±42.0 °C(Predicted)
[density ]

1.223
[storage temp. ]

0-6°C
[form ]

neat
[Major Application]

agriculture
environmental
[InChI]

1S/C12H16O4S/c1-4-17(13,14)16-9-5-6-11-10(7-9)12(2,3)8-15-11/h5-7H,4,8H2,1-3H3
[InChIKey]

QGQSRQPXXMTJCM-UHFFFAOYSA-N
[SMILES]

CCS(=O)(=O)Oc1ccc2OCC(C)(C)c2c1
Safety DataBack Directory
[Risk Statements ]

52/53
[Safety Statements ]

61
[WGK Germany ]

1
[RTECS ]

KI7372000
[Storage Class]

11 - Combustible Solids
Hazard InformationBack Directory
[Chemical Properties]

Furosemide original drug purity ≥95%, melting point 32~35℃. Pure product is gray-white crystals (industrial product is dark brown highly viscous solution), with a slight odor, melting point 30.1 ℃. Vapor pressure:1.43mPa( 20℃),2.78mPa(25℃). Relative density:0.957, Kow lgP=2.41(20℃). Solubility in water 261mg/L(25℃). Solubility in organic solvents (g/L): acetone>1050, dichloromethane>1220, toluene>1040, methanol>980, ethyl acetate>920, cyclohexane51, n-hexane15.3. Stable in aqueous solution placed at 37°C, pH 5.0, 7.0, 9.2 for 31d. 0.1mol/L sodium hydroxide DT50 in aqueous solution is 12.5d. flash point 37.5°C (determined by Abel-Pinsky method), non-flammable.
[Uses]

Benfuresate may be used as a reference standard in the determination of the analyte in water and urine samples by an analytical method based on coupling photo-induced chemiluminescence in a multicommutation continuous flow methodology.', 'Refer to the productμs Certificate of Analysis for more information on a suitable instrument technique. Contact Technical Service for further support.
[Definition]

ChEBI: Benfuresate is a member of benzofurans.
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