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10531-13-2

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10531-13-2 Structure

10531-13-2 Structure
IdentificationBack Directory
[Name]

Cyanomethyl benzenesulfonate
[CAS]

10531-13-2
[Synonyms]

CMBS
CYANOMETHYL BENZENESULFONATE
cyanomethyl benzenesulphonate
[(Phenylsulfonyl)oxy]acetonitrile
cyanomethylbenzenesulfonatetech80%
Benzenesulfonic acid cyanomethyl ester
Cyanomethyl benzenesulfonate,80%,tech.
CYANOMETHYL BENZENESULFONATE, TECH., 80%
Cyanomethyl benzenesulfonate 80%, technical grade
[EINECS(EC#)]

234-093-6
[Molecular Formula]

C8H7NO3S
[MDL Number]

MFCD00007547
[MOL File]

10531-13-2.mol
[Molecular Weight]

197.21
Chemical PropertiesBack Directory
[Melting point ]

32-33 °C
[Boiling point ]

142-146 °C/1 mmHg (lit.)
[density ]

1.309 g/mL at 25 °C (lit.)
[refractive index ]

n20/D 1.523(lit.)
[Fp ]

>230 °F
[InChI]

1S/C8H7NO3S/c9-6-7-12-13(10,11)8-4-2-1-3-5-8/h1-5H,7H2
[InChIKey]

SSOVHFPWMPUQOS-UHFFFAOYSA-N
[SMILES]

O=S(=O)(OCC#N)c1ccccc1
[EPA Substance Registry System]

Acetonitrile, [(phenylsulfonyl)oxy]- (10531-13-2)
Safety DataBack Directory
[Hazard Codes ]

Xn
[Risk Statements ]

20/21/22-34
[Safety Statements ]

26-27-36/37/39
[RIDADR ]

UN 1760 8/PG 2
[WGK Germany ]

3
[HazardClass ]

8
[PackingGroup ]

III
[Storage Class]

8A - Combustible corrosive hazardous materials
[Hazard Classifications]

Acute Tox. 4 Oral
Eye Dam. 1
Skin Corr. 1B
Hazard InformationBack Directory
[Uses]

Cyanomethyl benzenesulfonate was used in the synthesis of nido-and closo-arsacarboranes. It was used in separation of aromatic hydrophobic sulfonates by micellar electrokinetic chromatography using different buffer system.
[General Description]

Cyanomethyl benzenesulfonate is a potential cyanomethylating agent.
Spectrum DetailBack Directory
[Spectrum Detail]

Cyanomethyl benzenesulfonate(10531-13-2)Raman
Cyanomethyl benzenesulfonate(10531-13-2)IR
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