1-[3-(Trifluoromethyl)phenyl]-1-propanone

Basic Information

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CAS Number

1533-03-5

Molecular Formula

C10H9F3O

Molecular Weight

202.17 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Ketones

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Specialty Chemicals UV Stabilizers

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

Melting Point

18 °C

Boiling Point

102°C/17mmHg

Flash Point

108℃(226℉)(lit.)

Refractive Index

n20/D 1.4620(lit.)

SMILES

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

InChI

InChI=1S/C10H9F3O/c1-2-9(14)7-4-3-5-8(6-7)10(11,12)13/h3-6H,2H2,1H3

InChIKey

UBTPNKXHYILGJU-UHFFFAOYSA-N

LogP

3.2981000000000016

Topological Polar Surface Area

17.07 Å²

Hydrogen Bond Donor/Acceptor

0 / 1

Complexity

210

Safety Information

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Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral

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

SCHEMBL716488
3-(Trifluoromethyl)propiophenone
CS-W015518
MFCD00039227
3/'-(TRIFLUOROMETHYL)PROPIOPHENONE
AMY24808
PS-8186
3'-(Trifluoromethyl)propiophenone
3'-(Trifluoromethyl)propiophenone, 97%
m-Trifluoromethylpropiophenone
AC-11413
3-(trifluoromethyl) propiophenone
3 inverted exclamation mark -(Trifluoromethyl)propiophenone
1533-03-5
1-[3-(Trifluoromethyl)phenyl]-1-propanone
T2404
DTXSID20165307
1-[3-(trifluoromethyl)phenyl]propan-1-one
FT-0613957
J-008999
1-Propanone, 1-(3-(trifluoromethyl)phenyl)-
1-(3-(Trifluoromethyl)phenyl)propan-1-one
AKOS009158482
1-Propanone, 1-[3-(trifluoromethyl)phenyl]-
A3369
Propiophenone, 3'-(trifluoromethyl)
SY021816
ethyl 3-(trifluoromethyl)phenyl ketone
3-(trifluoromethyl)propiophenone
3′-(Trifluoromethyl)propiophenone
3`- (Trifluoromethyl)propiophenone

MDL Number

MFCD00039227

Customs Code

2914399090

FAQ

What is 1-[3-(Trifluoromethyl)phenyl]-1-propanone (CAS: 1533-03-5)?

1-[3-(Trifluoromethyl)phenyl]-1-propanone is a ketone compound with the CAS number 1533-03-5. It has the molecular formula C9H7FO3 and is characterized by its trigonal planar molecular structure, containing a trifluoromethyl group attached to a phenyl ring.

What are the main uses of 1-[3-(Trifluoromethyl)phenyl]-1-propanone (CAS: 1533-03-5)?

1-[3-(Trifluoromethyl)phenyl]-1-propanone is primarily used as an intermediate in the synthesis of pharmaceuticals, particularly in the production of anti-inflammatory and analgesic drugs. It is also used in the formulation of certain agrochemicals and as a reagent in organic synthesis.

Is 1-[3-(Trifluoromethyl)phenyl]-1-propanone (CAS: 1533-03-5) safe?

1-[3-(Trifluoromethyl)phenyl]-1-propanone (CAS: 1533-03-5) is generally safe when handled with proper precautions. However, it is important to follow safety guidelines, such as wearing appropriate personal protective equipment (PPE) and ensuring good ventilation. Direct contact with skin and eyes should be avoided, and it should be stored away from direct heat and sources of ignition.

How should 1-[3-(Trifluoromethyl)phenyl]-1-propanone (CAS: 1533-03-5) be stored?

1-[3-(Trifluoromethyl)phenyl]-1-propanone (CAS: 1533-03-5) should be stored in cool, dry conditions, preferably below 25°C, to maintain its stability. It should be kept away from direct sunlight and stored in a tightly sealed container to prevent moisture and air exposure. Properly labeled and secured storage is essential to ensure safety and efficacy.