(2E)-3-[4-(Trifluoromethyl)phenyl]acrylic acid

Basic Information

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CAS Number

16642-92-5

Molecular Formula

C10H7F3O2

Molecular Weight

216.16 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Specialty Chemicals UV Stabilizers

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

Physical State

White cryst.

Melting Point

229.0 to 233.0 deg-C

Boiling Point

279.2°C at 760 mmHg

Flash Point

122.6℃

SMILES

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C1=CC(=CC=C1C=CC(=O)O)C(F)(F)F

InChI

InChI=1S/C10H7F3O2/c11-10(12,13)8-4-1-7(2-5-8)3-6-9(14)15/h1-6H,(H,14,15)/b6-3+

InChIKey

ANRMAUMHJREENI-ZZXKWVIFSA-N

LogP

2.8032000000000004

Topological Polar Surface Area

37.3 Å²

Hydrogen Bond Donor/Acceptor

1 / 2

Complexity

250

Safety Information

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GHS Hazard Pictograms

H315

H319

H335

Hazard Statement

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

H335 May cause respiratory irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation

Hazard Class

Class IRRITANT Class IRRITANT

Synonyms & References

English

CHEBI:60705
3-[4-(TRIFLUOROMETHYL)PHENYL]-2-PROPENOIC ACID
YH27VC974F
MFCD00002696
CHEMBL1927249
(E)-3-(4-trifluoromethyl-phenyl)-acrylic acid
(E)-4-(TRIFLUOROMETHYL)CINNAMIC ACID
4-Trifluoromethylcinnamic acid, trans-
NS00046523
(E)-3-[4'-(trifluoromethyl)phenyl]-2-propenoic acid
EN300-07720
4-trifluoromethyl-E-cinnamic acid
DTXSID501224492
2062-26-2
J-010280
J-501905
Q27128549
AKOS000263780
(e)-3-(4-(trifluoromethyl)phenyl)acrylic acid
3-[4-(trifluoromethyl)phenyl]prop-2-enoic acid
p-(Trifluoromethyl)cinnamic acid
trans-4-(Trifluoromethyl)cinnamic acid
2-Propenoic acid, 3-(4-(trifluoromethyl)phenyl)-, (2E)-
A814750
16642-92-5
HMS1410N11
EN300-344794
2-Propenoic acid, 3-(4-(trifluoromethyl)phenyl)-
(2E)-3-(4-(Trifluoromethyl)phenyl)-2-propenoic acid
(E)-3-(4-(Trifluoromethyl)phenyl)-2-propenoic acid
(2E)-3-[4-(Trifluoromethyl)phenyl]-2-propenoic acid

MDL Number

MFCD00002696

Customs Code

2916399090

FAQ

What regulatory guidelines apply to (2E)-3-[4-(Trifluoromethyl)phenyl]acrylic acid (CAS: 16642-92-5)?

Regulatory guidelines for (2E)-3-[4-(Trifluoromethyl)phenyl]acrylic acid (CAS: 16642-92-5) include GHS classification, REACH regulations, FDA requirements for pharmaceutical applications, and EPA guidelines for environmental protection. Specific handling, storage, and disposal requirements must be followed to ensure compliance with these regulations.

Are there alternatives to (2E)-3-[4-(Trifluoromethyl)phenyl]acrylic acid in synthesis?

Alternatives to (2E)-3-[4-(Trifluoromethyl)phenyl]acrylic acid in synthesis include other acrylic acid derivatives such as acrylic acid itself, substituted acrylic acids, and related compounds like (Z)- and (E)-isomers. Other common reagents include trifluoromethylated aldehydes and ketones, which can be used as precursors in alternative synthesis routes.

What is the market or research trend for (2E)-3-[4-(Trifluoromethyl)phenyl]acrylic acid?

The market trend for (2E)-3-[4-(Trifluoromethyl)phenyl]acrylic acid highlights increasing research in its use as an intermediate in pharmaceutical and agrochemical industries. Recent studies focus on its potential in drug development and novel pesticide formulations. The rising demand is driven by its unique chemical properties and promising applications.

How should waste containing (2E)-3-[4-(Trifluoromethyl)phenyl]acrylic acid be handled?

Waste containing (2E)-3-[4-(Trifluoromethyl)phenyl]acrylic acid (CAS: 16642-92-5) should be collected and stored in appropriate containers to prevent spills or leaks. Proper disposal methods include incineration in a controlled environment or through professional waste disposal services. Environmental precautions involve minimizing exposure to air, water, and soil to ensure compliance with environmental protection standards.