Ethyl 2-methyl-2-(phenylthiocarbonylthio)propionate

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Product Information

Molecular Formula:
C13H16O2S2
Molecular Weight:
268.39
Description
RAFT agent for controlled radical polymerization; well-suited for polymerization of methacrylates, methacrylamides, and to a lesser extent styrenes, acrylates, and acrylamides. Chain Transfer Agent (CTA)
Synonyms
2-(Ethoxycarbonyl)-2-propyldithiobenzoate,ECPDB
IUPAC Name
ethyl 2-(benzenecarbonothioylsulfanyl)-2-methylpropanoate
Canonical SMILES
CCOC(=O)C(C)(C)SC(=S)C1=CC=CC=C1
InChI
InChI=1S/C13H16O2S2/c1-4-15-12(14)13(2,3)17-11(16)10-8-6-5-7-9-10/h5-9H,4H2,1-3H3
InChI Key
MDFLMFRGXQRZII-UHFFFAOYSA-N
Flash Point
>230 °F
Purity
95%
Appearance
solid or liquid
Storage
2-8°C
Refractive Index
n20/D 1.600

Computed Properties

XLogP3
3.8
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
4
Rotatable Bond Count
6
Exact Mass
268.05917210 g/mol
Monoisotopic Mass
268.05917210 g/mol
Topological Polar Surface Area
83.7Ų
Heavy Atom Count
17
Formal Charge
0
Complexity
281
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
CN-113336902-A Tea saponin modified compound water reducing agent and preparation method and application thereof 2021-08-09
CN-113354779-A Esterified tea saponin modified composite water reducing agent and preparation method and application thereof 2021-08-09
CN-113336902-B Tea saponin modified compound water reducing agent and preparation method and application thereof 2021-08-09
CN-113354779-B Esterified tea saponin modified composite water reducing agent and preparation method and application thereof 2021-08-09
US-2022066345-A1 Photoresponsive polymer, photoresponsive adhesive, toner, and image forming method 2020-08-28
US-2022043366-A1 Photoresponsive polymer 2020-08-07
EP-3954732-A1 Rubber composition, vulcanized product, and vulcanized molded article 2019-08-23
WO-2020226178-A1 Fluoropolymer production method and fluoropolymer 2019-05-08
EP-3940002-A1 Rubber latex and water-based adhesive composition 2019-03-15
EP-3696200-A1 Photoresponsive high-molecular weight material, adhesive, toner, and image forming method 2019-02-14
The molarity calculator equation

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

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The dilution calculator equation

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

This equation is commonly abbreviated as: C1V1 = C2V2

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