p-Chlorostyrene

Product Information

Molecular Formula:
C8H7Cl
Molecular Weight:
138.59418
Description
4-Chlorostyrene was used in the following studies:• Study of chemical and biochemical properties of the vinyl group of styrene by the development of structure activity relationships (SAR). • Preparation of new bis(pyrazolyl)borato olefin complexes of copper(I).• To investigate the regioselectivity in the cationic Heck reaction of 4-substituted styrenes.
Synonyms
4-Chlorostyrene; 1073-67-2; P-CHLOROSTYRENE; 1-Chloro-4-vinylbenzene; Styrene,p-chloro-; Parachlorostyrene
IUPAC Name
1-chloro-4-ethenylbenzene
Canonical SMILES
C=CC1=CC=C(C=C1)Cl
InChI
InChI=1S/C8H7Cl/c1-2-7-3-5-8(9)6-4-7/h2-6H,1H2
InChI Key
KTZVZZJJVJQZHV-UHFFFAOYSA-N
Boiling Point
192°C
Melting Point
-16°C
Flash Point
64 °C
Purity
95%
Density
1.155
Solubility
Insol in water
Appearance
Clear, colorless liquid.
Application
Used to make polychlorostyrene.
Storage
2-8°C
Refractive Index
1.5645-1.5665
Vapor Pressure
0.81 [mmHg]
Decomposition
When heated to decomposition, it emits /hydrogen chloride. /Chlorostyrene/

Safety Information

Hazards
H302+H312+H332:
Harmful if swallowed.
Harmful in contact with skin.
Harmful if inhaled.
H315:
Causes skin irritation.
H319:
Causes serious eye irritation.
Precautionary Statement
P261:
Avoid breathing dust, fumes, gas, mist, vapours, spray. [As modified by IV ATP].
P264:
Wash thoroughly after handling.
P280:
Wear protective gloves/protective clothing/eye protection/face protection.
P302+P352+P312:
IF ON SKIN:
Wash with plenty of soap and water.
Call a POISON CENTER or doctor/physician if you feel unwell.
P304+P340+P312:
IF INHALED:
Remove person to fresh air and keep comfortable for breathing.
Call a POISON CENTER or doctor/physician if you feel unwell.
P337+P313:
If eye irritation persists:
Get medical advice/attention.

Computed Properties

XLogP3
3.7
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
0
Rotatable Bond Count
1
Exact Mass
138.0236279 g/mol
Monoisotopic Mass
138.0236279 g/mol
Topological Polar Surface Area
0Ų
Heavy Atom Count
9
Formal Charge
0
Complexity
90.7
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-2021125132-A1 Carbamoyl oxime compound, and polymerization initiator and polymerizable composition containing said compound 2019-12-20
EP-3835330-A1 Aqueous dispersion of polymer particles and uses thereof as an adhesive composition 2019-12-13
US-2021181647-A1 Toner and two component developer 2019-12-13
WO-2021116415-A1 Aqueous dispersion of polymer particles and uses thereof as an adhesive composition 2019-12-13
WO-2021117723-A1 Block copolymer, resin composition, stretch conductor, electronic device, and pressure-sensitive adhesive film 2019-12-13
WO-2021115978-A1 Polymer latex for use in construction applications 2019-12-10
WO-2021117637-A1 Method for producing styrene-based resin particles, styrene-based resin particles, resin compositions for low-dielectric material, and molded object 2019-12-10
WO-2021117537-A1 Member for fogging prevention, suppression of water droplet adhesion, suppression of icing, or suppression of ice nucleus formation 2019-12-09
WO-2021117538-A1 Material and sliding system 2019-12-09
EP-3831617-A1 Tread 2019-12-05

Literatures

PMID Publication Date Title Journal
22366341 2012-05-05 Structure-toxicity relationship study of para-halogenated styrene analogues in CYP2E1 transgenic cells Toxicology letters
21619852 2011-02-01 [Determination of o-chlorostyrene in the air of workplace by gas chromatography] Zhonghua lao dong wei sheng zhi ye bing za zhi = Zhonghua laodong weisheng zhiyebing zazhi = Chinese journal of industrial hygiene and occupational diseases
20199059 2010-04-02 Heterogeneous allylsilylation of aromatic and aliphatic alkenes catalyzed by proton-exchanged montmorillonite Organic letters
18220391 2008-02-20 Bimetallic effects in homopolymerization of styrene and copolymerization of ethylene and styrenic comonomers: scope, kinetics, and mechanism Journal of the American Chemical Society
16855758 2006-08-07 Synthesis, characterization and olefin/CO exchange reactions of pyrazolylborato complexes of copper(I) Dalton transactions (Cambridge, England : 2003)
16416502 2006-02-08 Manganese-substituted carbonic anhydrase as a new peroxidase Chemistry (Weinheim an der Bergstrasse, Germany)
15592614 2004-12-21 Catalytic asymmetric heterogeneous aziridination of styrene derivatives using bis(oxazoline)-modified Cu2+-exchanged zeolite Y Organic & biomolecular chemistry
15600387 2004-10-01 Crystal-like pattern formation in polymerization-induced phase separation Physical review. E, Statistical, nonlinear, and soft matter physics
12919018 2003-08-22 A cyclodextrin-modified ketoester for stereoselective epoxidation of alkenes The Journal of organic chemistry
11341314 2001-04-01 Biotransformations catalyzed by cloned p-cymene monooxygenase from Pseudomonas putida F1 Applied microbiology and biotechnology
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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