234184
Methyl phenylsulfonylacetate
97%
Synonym(s):
Methyl benzenesulfonylacetate
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About This Item
Linear Formula:
C6H5SO2CH2COOCH3
CAS Number:
Molecular Weight:
214.24
Beilstein:
2051463
MDL number:
UNSPSC Code:
12352100
PubChem Substance ID:
NACRES:
NA.22
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Assay
97%
refractive index
n20/D 1.535 (lit.)
bp
165 °C/0.05 mmHg (lit.)
density
1.305 g/mL at 20 °C (lit.)
functional group
ester
sulfone
SMILES string
COC(=O)CS(=O)(=O)c1ccccc1
InChI
1S/C9H10O4S/c1-13-9(10)7-14(11,12)8-5-3-2-4-6-8/h2-6H,7H2,1H3
InChI key
NLEAIFBNKPYTGN-UHFFFAOYSA-N
Gene Information
human ... LOC129293(129293)
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Application
Methyl phenylsulfonylacetate has been used:
- in a key step during the synthesis of (−)-hybridalactone, marine eicosanoid isolated from the red alga Laurencia hybrida
- in dehydrative alkylation of alcohols under modified Mitsunobu conditions followed by desulfonylation using magnesium
- in three step synthesis of 2-(hydroxymethyl)indene
Storage Class Code
10 - Combustible liquids
WGK
WGK 3
Flash Point(F)
172.4 °F - closed cup
Flash Point(C)
78 °C - closed cup
Personal Protective Equipment
dust mask type N95 (US), Eyeshields, Gloves
Regulatory Information
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Find documentation for the products that you have recently purchased in the Document Library.
An improved synthesis of 2-(hydroxymethyl) indene.
Palandoken H, et al.
Organic Prep. and Proc. Int., 28(6), 702-704 (1996)
Methyl Carboxymethylenation of Alcohols via Dehydrative Alkylation.
YuJ, et al.
Synlett, 1995(11), 1127-1128 (1995)
Koichiro Ota et al.
Chemistry (Weinheim an der Bergstrasse, Germany), 18(42), 13531-13537 (2012-09-12)
(-)-Hybridalactone (1) is a marine eicosanoid isolated from the red alga Laurencia hybrida. This natural product contains cyclopropane, cyclopentane, 13-membered macrolactone and epoxide ring systems incorporating seven stereogenic centers. Moreover, this compound has an acid-labile skipped Z,Z-diene motif. In this
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