2-Cyano-2-propyl benzodithioate
Product Information
Molecular Formula
C11H11NS2
Molecular Weight
221.34
Description
Reversible Addition Fragmentation Chain Transfer (RAFT) Polymerization
Synonyms
2-Cyanopropan-2-yl benzodithioate
IUPAC Name
2-cyanopropan-2-yl benzenecarbodithioate
SMILES
CC(C)(C#N)SC(=S)C1=CC=CC=C1
InChI
InChI=1S/C11H11NS2/c1-11(2,8-12)14-10(13)9-6-4-3-5-7-9/h3-7H,1-2H3
InChI Key
IDSLBLWCPSAZBL-UHFFFAOYSA-N
Flash Point
>230 °F
Purity
>97% (HPLC)
Appearance
solid or liquid
Storage
2-8°C
Refractive Index
n20/D 1.621
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
P231:
Handle under inert gas.
P235:
Keep cool.
P305+P351+P338:
IF IN EYES:
Rinse cautiously with water for several minutes.
Remove contact lenses if present and easy to do. Continue rinsing.
P403+P233:
Store in a well ventilated place.
Keep container tightly closed.
P410:
Protect from sunlight.
P422:
Store contents under...
P501:
Dispose of contents/container in accordance with local/regional/national/international regulations.
Handle under inert gas.
P235:
Keep cool.
P305+P351+P338:
IF IN EYES:
Rinse cautiously with water for several minutes.
Remove contact lenses if present and easy to do. Continue rinsing.
P403+P233:
Store in a well ventilated place.
Keep container tightly closed.
P410:
Protect from sunlight.
P422:
Store contents under...
P501:
Dispose of contents/container in accordance with local/regional/national/international regulations.
Computed Properties
XLogP3
3.3
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
3
Rotatable Bond Count
3
Exact Mass
221.03329170 g/mol
Monoisotopic Mass
221.03329170 g/mol
Topological Polar Surface Area
81.2Ų
Heavy Atom Count
14
Formal Charge
0
Complexity
256
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-113861656-A | Preparation method of polycarbonate insulating material | 2021-10-15 |
| CN-113417025-A | Preparation method of polyacrylonitrile for high-performance carbon fibers | 2021-07-16 |
| CN-113754843-A | Preparation and application method of silicon-containing rapid graphical block copolymer | 2021-05-26 |
| US-2022066345-A1 | Photoresponsive polymer, photoresponsive adhesive, toner, and image forming method | 2020-08-28 |
| JP-2022036439-A | A novel polyion complex with an upper critical solution temperature | 2020-08-24 |
| US-2022040108-A1 | Light upconversion silica particles | 2020-08-07 |
| US-2022043366-A1 | Photoresponsive polymer | 2020-08-07 |
| KR-20220013066-A | Modified oligomer, modified conjugated diene-based polymer comprising functional group derived from thereof and method for preparing the polymer | 2020-07-24 |
| WO-2022006703-A1 | Composition, coating formulation, and multilayer body | 2020-07-06 |
| KR-20210157034-A | Composition for selective layer of reverse osmosis membrane, reverse osmosis membrane using the same and method for manufacturing the same | 2020-06-19 |
