Carbonotrithioic acid,bis(phenylmethyl) ester
Product Information
Molecular Formula
C15H14 S3
Molecular Weight
290.47
Description
Trithiocarbonate-based RAFT agent used as a bifunctional Chain Transfer Agent (CTA) in RAFT polymerization of block copolymers for drug delivery. Provides good control of polymerization of vinyl monomers, including styrene, methacrylate, and acrylamide.
Synonyms
dibenzyl esterCarbonotrithioic acid bis(phenylmethyl) ester/DBTTC/Dibenzyl carbonotrithioate,
IUPAC Name
bis(benzylsulfanyl)methanethione
SMILES
C1=CC=C(C=C1)CSC(=S)SCC2=CC=CC=C2
InChI
InChI=1S/C15H14S3/c16-15(17-11-13-7-3-1-4-8-13)18-12-14-9-5-2-6-10-14/h1-10H,11-12H2
InChI Key
LAKYXBYUROTWBI-UHFFFAOYSA-N
Flash Point
>230 °F
Purity
min. 97%
Appearance
dark yellow liq.
Storage
2-8°C
Refractive Index
n20/D 1.535
Safety Information
Hazards
H315:
Causes skin irritation.
H319:
Causes serious eye irritation.
H335:
May cause respiratory irritation.
Causes skin irritation.
H319:
Causes serious eye irritation.
H335:
May cause respiratory irritation.
Precautionary Statement
P101:
If medical advice is needed, have product container or label at hand.
P102:
Keep out of reach of children.
P103:
Read label before use.
P222:
Do not allow contact with air.
P231:
Handle under inert gas.
P235:
Keep cool.
P262:
Do not get in eyes, on skin, or on clothing.
P305+P351+P338:
IF IN EYES:
Rinse cautiously with water for several minutes.
Remove contact lenses if present and easy to do. Continue rinsing.
P501:
Dispose of contents/container in accordance with local/regional/national/international regulations.
If medical advice is needed, have product container or label at hand.
P102:
Keep out of reach of children.
P103:
Read label before use.
P222:
Do not allow contact with air.
P231:
Handle under inert gas.
P235:
Keep cool.
P262:
Do not get in eyes, on skin, or on clothing.
P305+P351+P338:
IF IN EYES:
Rinse cautiously with water for several minutes.
Remove contact lenses if present and easy to do. Continue rinsing.
P501:
Dispose of contents/container in accordance with local/regional/national/international regulations.
Computed Properties
XLogP3
5.2
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
3
Rotatable Bond Count
6
Exact Mass
290.02576397 g/mol
Monoisotopic Mass
290.02576397 g/mol
Topological Polar Surface Area
82.7Ų
Heavy Atom Count
18
Formal Charge
0
Complexity
216
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-113871705-A | Self-repairing polyion liquid-based electrolyte and preparation and application thereof | 2021-09-27 |
| CN-113831455-A | Core-shell particles for toughening epoxy resin and preparation method thereof | 2021-08-19 |
| CN-113831484-A | VP block copolymer and preparation method and application thereof | 2021-08-16 |
| CN-113402721-A | Mixed crystal phase TiO2Grafted polymethyl methacrylate denture base resin and preparation method thereof | 2021-05-24 |
| CN-113087929-A | Hydrogen bond supermolecule polymer nano-particle and preparation method thereof | 2021-03-08 |
| CN-113087929-B | Hydrogen bond supermolecule polymer nano-particle and preparation method thereof | 2021-03-08 |
| CN-112279981-A | Polymer binder containing soft phase region and hard phase region and preparation method and application thereof | 2020-10-20 |
| JP-6834050-B1 | Pigment dispersant composition and its manufacturing method, pigment dispersion liquid, and active energy ray-curable inkjet ink | 2020-09-03 |
| JP-2022042817-A | Pigment dispersant composition and its manufacturing method, pigment dispersion liquid, and active energy ray-curable inkjet ink. | 2020-09-03 |
| WO-2022050017-A1 | Pigment dispersant composition, production method therefor, pigment dispersion, and actinic-ray-curable ink-jet ink | 2020-09-03 |
Literatures
| PMID | Publication Date | Title | Journal |
|---|---|---|---|
| 20345117 | 2010-06-01 | Controlled synthesis of polymeric nanocapsules by RAFT-based vesicle templating | Langmuir : the ACS journal of surfaces and colloids |
| 19534456 | 2009-09-15 | Polymer encapsulated gibbsite nanoparticles: efficient preparation of anisotropic composite latex particles by RAFT-based starved feed emulsion polymerization | Langmuir : the ACS journal of surfaces and colloids |
