2-(4-Methoxyphenylcarbonothioylthio)ethanoic acid

Product Information

Molecular Formula:
C10H10O3S2
Molecular Weight:
242.31
Description
RAFT agent for controlled radical polymerization; especially suited for the polymerization of methacrylate and methacrylamide monomers. Chain Transfer Agent (CTA) with electron donating group to increase fragmentation and reduce polymerization time.
Synonyms
(4-Methoxybenzothioylthio)ethanoic acid,2-[(4-Methoxyphenylthioxomethyl)thio]ethanoic acid
IUPAC Name
2-(4-methoxybenzenecarbothioyl)sulfanylacetic acid
Canonical SMILES
COC1=CC=C(C=C1)C(=S)SCC(=O)O
InChI
InChI=1S/C10H10O3S2/c1-13-8-4-2-7(3-5-8)10(14)15-6-9(11)12/h2-5H,6H2,1H3,(H,11,12)
InChI Key
OYGMVZNPQIMDSA-UHFFFAOYSA-N
Boiling Point
275.2-284.4 °C
Flash Point
>230 °F
Purity
≥97%
Appearance
liquid
Storage
2-8°C
Refractive Index
n20/D 1.6288

Computed Properties

XLogP3
2.5
Hydrogen Bond Donor Count
1
Hydrogen Bond Acceptor Count
5
Rotatable Bond Count
5
Exact Mass
242.00713652 g/mol
Monoisotopic Mass
242.00713652 g/mol
Topological Polar Surface Area
104Ų
Heavy Atom Count
15
Formal Charge
0
Complexity
235
Isotope Atom Count
0
Defined Atom Stereocenter Count
0
Undefined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
0
Undefined Bond Stereocenter Count
0
Covalently-Bonded Unit Count
1
Compound Is Canonicalized
Yes

Patents

Publication Number Title Priority Date
WO-2020122422-A1 Acrylic copolymer, preparation method therefor, and acrylic copolymer composition comprising same 2018-12-13
CN-111801362-A Acrylic copolymer, method for preparing the same, and acrylic copolymer composition comprising the same 2018-12-13
EP-3750928-A1 Acrylic copolymer, preparation method therefor, and acrylic copolymer composition comprising same 2018-12-13
KR-20200073065-A Acryl based copolymer, method for preparing the same and acryl based copolymer composition comprising the acryl based copolymer 2018-12-13
US-2021002401-A1 Acrylic Copolymer, Method of Preparing the Same, and Acrylic Copolymer Composition Including the Same 2018-12-13
JP-2021515078-A Acrylic copolymer, a method for producing the same, and an acrylic copolymer composition containing the same. 2018-12-13
US-2021276931-A1 Energetic Feedstock for Additive Manufacturing 2018-11-27
KR-20190123566-A Gel-type polymer electrolyte membrane and the manufacruting method thereof 2018-04-24
KR-102131766-B1 Gel-type polymer electrolyte membrane and the manufacruting method thereof 2018-04-24
WO-2019097025-A1 Polymer prodrugs and subcutaneous and/or intramuscular administration thereof 2017-11-17
The molarity calculator equation

Mass (g) = Concentration (mol/L) × Volume (L) × Molecular Weight (g/mol)

The dilution calculator equation

Concentration (start) × Volume (start) = Concentration (final) × Volume (final)

This equation is commonly abbreviated as: C1V1 = C2V2

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