3-(Trifluoromethyl)styrene

Inquiry

Molecular Formula:

C9H7F3

Molecular Weight:

172.15

CAS Number:

402-24-4

Catalog Number:

402-24-4

Product Information

Molecular Formula:

C9H7F3

Molecular Weight:

172.15

Description

Applications: 3-(Trifluoromethyl)styrene is a useful research chemical.

Synonyms

Benzene, 1-(trifluoromethyl)-3-(ethenyl)-; 3-(TRIFLUOROMETHYL)STYRENE; 3-(Trifluoromethyl)styrene, stabilized; 3-(TRIFLUOROMETHYL)STYRENE, 98% MIN.; M-TRIFLUOROMETHYLSTYRENE; 3-(Trifluoromethyl)styrene, 97+%, stabilised

IUPAC Name

1-ethenyl-3-(trifluoromethyl)benzene

Canonical SMILES

C=CC1=CC(=CC=C1)C(F)(F)F

InChI

InChI=1S/C9H7F3/c1-2-7-4-3-5-8(6-7)9(10,11)12/h2-6H,1H2

InChI Key

ARHOUOIHKWELMD-UHFFFAOYSA-N

Boiling Point

64.5ºC (40 mmHg)

Flash Point

107.6 ℃F - closed cup

Purity

95%

Density

1.161

Appearance

Colorless to Almost colorless clear liquid

Storage

Refrigerator (+4ºC) + Flammables area

Refractive Index

n20/D 1.465 (lit.)

Safety Information

Hazards

H226:
Flammable liquid and vapour.

Precautionary Statement

P210:
Keep away from heat, sparks, open flames, hot surfaces. No smoking.
P233:
Keep container tightly closed.
P303+P361+P353:
IF ON SKIN (or hair):
Take off immediately all contaminated clothing. [As modified by IV ATP].
Rinse skin with water/shower.
P370+P378:
In case of fire:
Use for extinction:
P403+P235:
Store in a well ventilated place.
Keep cool.
P501:
Dispose of contents/container in accordance with local/regional/national/international regulations.

Computed Properties

XLogP3

3.7

Hydrogen Bond Donor Count

Hydrogen Bond Acceptor Count

Rotatable Bond Count

Exact Mass

172.04998471 g/mol

Monoisotopic Mass

172.04998471 g/mol

Topological Polar Surface Area

0Å²

Heavy Atom Count

Formal Charge

Complexity

160

Isotope Atom Count

Defined Atom Stereocenter Count

Undefined Atom Stereocenter Count

Defined Bond Stereocenter Count

Undefined Bond Stereocenter Count

Covalently-Bonded Unit Count

Compound Is Canonicalized

Yes

Patents

Publication Number	Title	Priority Date
CN-114106814-A	Quantum dot photoluminescent film, preparation method thereof and display device	2021-11-23
CN-114029016-A	Styrene self-polymerization prevention device and process	2021-11-12
CN-113773676-A	Super-hardness inorganic polymer steel bar anticorrosive paint and preparation method and application thereof	2021-09-29
CN-113756106-A	Waterproof and corrosion-resistant polypropylene fabric and preparation process thereof	2021-09-28
CN-113894029-A	Antibacterial coating process	2021-09-24
CN-215801519-U	Riverbed soil body horizontal displacement monitoring devices based on water pressure difference	2021-08-06
CN-113441021-A	Temperature-controllable rubber dissolving tank	2021-08-02
CN-214528823-U	Polymer asphalt self-adhesive waterproof coiled material	2021-04-14
CN-112898851-A	Single-component water-based transparent antirust coating and preparation method thereof	2021-03-30
CN-113121388-A	Cinacalcet intermediate and synthetic method of cinacalcet hydrochloride	2021-03-29

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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