2-Phenyl-2-propyl benzodithioate

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Product Information

Molecular Formula:
C16H16S2
Molecular Weight:
272.43
Description
RAFT agent for controlled radical polymerization; especially suited for the polymerization of methacrylates/methacrylamides, and to a lesser extent acrylates/acrylamides and styrenes; Chain Transfer Agent (CTA)
Synonyms
2-Phenylpro-2-yl dithiobenzoate, Benzenecarbodithioic acid 1-methyl-1phenylethyl ester, Cumyl dithiobenzoate
IUPAC Name
2-phenylpropan-2-yl benzenecarbodithioate
Canonical SMILES
CC(C)(C1=CC=CC=C1)SC(=S)C2=CC=CC=C2
InChI
InChI=1S/C16H16S2/c1-16(2,14-11-7-4-8-12-14)18-15(17)13-9-5-3-6-10-13/h3-12H,1-2H3
InChI Key
KOBJYYDWSKDEGY-UHFFFAOYSA-N
Boiling Point
275.2-284.4 °C
Melting Point
35.0 to 39.0 °C
Flash Point
219.2 °F
Purity
min. 97%
Density
1.125 g/mL at 25 °C
Appearance
Orange to Brown to Dark red powder to crystal
Storage
0-10°C
Refractive Index
n20/D 1.6288

Safety Information

Hazards
H413:
May cause long-lasting harmful effects to aquatic life.
Precautionary Statement
P273:
Avoid release to the environment.
P501:
Dispose of contents/container in accordance with local/regional/national/international regulations.

Computed Properties

XLogP3
5
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
2
Rotatable Bond Count
4
Exact Mass
272.06934286 g/mol
Monoisotopic Mass
272.06934286 g/mol
Topological Polar Surface Area
57.4Ų
Heavy Atom Count
18
Formal Charge
0
Complexity
271
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-114106516-A Epoxy resin composition, prepreg, laminated board and printed wiring board 2021-12-31
CN-114106519-A Modified epoxy resin matrix material for wide temperature range and preparation method and application thereof 2021-12-09
CN-114015062-A Preparation method of photoresponse type polydopamine-coated cellulose nanocrystal 2021-11-15
JP-2022041178-A Coated particles and their manufacturing method 2020-08-31
JP-2022039817-A Photoresponsive polymers, photoresponsive adhesives, toners, and image forming methods 2020-08-28
US-2022066345-A1 Photoresponsive polymer, photoresponsive adhesive, toner, and image forming method 2020-08-28
WO-2022034880-A1 Cell culture system, cell culture method, and culture medium additive 2020-08-12
JP-2022031010-A Photoresponsive polymer 2020-08-07
US-2022043366-A1 Photoresponsive polymer 2020-08-07
CN-113881001-A Block copolymer and process for producing the same 2020-07-02

Literatures

PMID Publication Date Title Journal
18652466 2008-08-20 Controlled cyclopolymerization through quantitative 19-membered ring formation Journal of the American Chemical Society
17599628 2007-10-08 Well-defined polymers with activated ester and protected aldehyde side chains for bio-functionalization Journal of controlled release : official journal of the Controlled Release Society
16602738 2006-04-01 Well-defined lactose-containing polymer grafted onto silica particles Biomacromolecules
15571417 2004-12-08 Consistent experimental and theoretical evidence for long-lived intermediate radicals in living free radical polymerization Journal of the American Chemical Society
12783552 2003-06-11 Stereoblock copolymers and tacticity control in controlled/living radical polymerization Journal of the American Chemical Society
12568604 2003-02-12 Ab initio evidence for slow fragmentation in RAFT polymerization Journal of the American Chemical Society
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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