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439401

Sigma-Aldrich

(Phenylthio)acetyl chloride

97%

Synonym(s):

Thiophenoxyacetyl chloride

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About This Item

Linear Formula:
C6H5SCH2COCl
CAS Number:
7031-27-8
Molecular Weight:
186.66
MDL number:
MFCD00054471
UNSPSC Code:
12352100
PubChem Substance ID:
24867505
NACRES:
NA.22

Assay

97%

form

liquid

refractive index

n20/D 1.5825 (lit.)

density

1.258 g/mL at 25 °C (lit.)

functional group

acyl chloride
thioether

SMILES string

ClC(=O)CSc1ccccc1

InChI

1S/C8H7ClOS/c9-8(10)6-11-7-4-2-1-3-5-7/h1-5H,6H2

InChI key

TWOLQIUHVMTAAE-UHFFFAOYSA-N

General description

(Phenylthio)acetyl chloride is an acid halide. It participates in the Friedel -Crafts acylation of arenes to afford α-sulfenylated acetophenones.

Pictograms

Corrosion
GHS05

Signal Word

Danger

Hazard Statements

H314

Hazard Classifications

Eye Dam. 1 - Skin Corr. 1B

Storage Class Code

8A - Combustible corrosive hazardous materials

WGK

WGK 3

Flash Point(F)

235.4 °F - closed cup

Flash Point(C)

113 °C - closed cup

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

Regulatory Information

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Certificates of Analysis (COA)

Lot/Batch Number
MKBP1669V
06717DJ
09105AH
04928MB
14926CA

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[3, 3]-Sigmatropic rearrangements: short, stereocontrolled syntheses of functionalized vitamin D 3 side-chain units.
Hatcher MA and Posner GH.
Tetrahedron Letters, 43(28), 5009-5012 (2002)

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