2,4-Dichloro-1,3-dinitro-5-(trifluoromethyl)benzene

Basic Information

View in Editor

CAS Number

29091-09-6

Molecular Formula

C7HCl2F3N2O4

Molecular Weight

304.99 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

Melting Point

72.0 to 76.0 deg-C

Boiling Point

291-294°C

Density

1.7880

Flash Point

>110°C

Refractive Index

1.547

SMILES

View in Editor

C1=C(C(=C(C(=C1[N+](=O)[O-])Cl)[N+](=O)[O-])Cl)C(F)(F)F

InChI

InChI=1S/C7HCl2F3N2O4/c8-4-2(7(10,11)12)1-3(13(15)16)5(9)6(4)14(17)18/h1H

InChIKey

DPQYRXNRGNLPFC-UHFFFAOYSA-N

LogP

4.87500

Complexity

356

Safety Information

View Safety Information

Hazard Statement

H242 Heating may cause a fire
Self-reactive substances and mixtures; and Organic peroxides

H302 Harmful if swallowed
Acute toxicity, oral

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

Hazard Class

Class 9 Class 9

Synonyms & References

English

AMY8667
TOLUENE, 2,4-DICHLORO-.ALPHA.,.ALPHA.,.ALPHA.-TRIFLUORO-3,5-DINITRO-
EC 249-420-8
Q27291188
D3315
2,4-Dichloro-3,5-dinitrobenzotrifluoride, AldrichCPR
AC-13855
UNII-UPF413436J
2,4-Dichloro-1,3-dinitro-5-(trifluoromethyl)benzene
AKOS015889877
2,4-dichloro-3,5-dinitro-benzotrifluoride
NCGC00256855-01
2,4-Dichloro-3,5-dinitro benzotrifluoride
CAS-29091-09-6
UPF413436J
NS00002403
29091-09-6
AS-12566
SCHEMBL2054426
2,4-CHLORO-3,5-DINITROBENZOTRIFLUORIDE
CHEMBL3185425
Benzene, 2,4-dichloro-1,3-dinitro-5-(trifluoromethyl)-
1,3-dichloro-2,6-dinitro-4-trifluoromethylbenzene
2,4-DICHLORO-1-(TRIFLUOROMETHYL)-3,5-DINITROBENZENE
EINECS 249-420-8
CK2302
Tox21_302530
W-107006
2,4-Dichloro-3,5-dinitrobenzotrifluoride
DTXCID5024639
DTXSID7044639

MDL Number

MFCD00042480

Customs Code

2904909090

FAQ

What is 2,4-Dichloro-1,3-dinitro-5-(trifluoromethyl)benzene (CAS: 29091-09-6)?

2,4-Dichloro-1,3-dinitro-5-(trifluoromethyl)benzene is an organic compound with the CAS number 29091-09-6. It has the chemical formula C7H3Cl2F3N2O4 and is known for its aromatic structure with multiple functional groups, including two nitro groups, two chlorine atoms, and a trifluoromethyl group. This compound is highly reactive and exhibits strong oxidizing properties due to the presence of nitro groups.

What are the main uses of 2,4-Dichloro-1,3-dinitro-5-(trifluoromethyl)benzene (CAS: 29091-09-6)?

2,4-Dichloro-1,3-dinitro-5-(trifluoromethyl)benzene is primarily used in the synthesis of pharmaceuticals and agrochemicals due to its versatile functional groups. It also serves as an intermediate in the production of dyes and other specialty chemicals. Its unique chemical structure makes it valuable in research for developing new compounds with specific reactivity and stability profiles.

Is 2,4-Dichloro-1,3-dinitro-5-(trifluoromethyl)benzene (CAS: 29091-09-6) safe?

2,4-Dichloro-1,3-dinitro-5-(trifluoromethyl)benzene is considered hazardous due to its potential toxicity. It should be handled with care, using appropriate personal protective equipment (PPE) such as gloves, goggles, and lab coats. Safety standards require it to be stored and used in well-ventilated areas, and exposure should be minimized to ensure compliance with occupational health and safety regulations.

How should 2,4-Dichloro-1,3-dinitro-5-(trifluoromethyl)benzene (CAS: 29091-09-6) be stored?

2,4-Dichloro-1,3-dinitro-5-(trifluoromethyl)benzene should be stored in a cool, dry, and dark place to maintain stability. It is recommended to keep it in a sealed container at temperatures below 25°C and away from moisture and light. Proper storage also involves keeping it in a well-ventilated area and away from incompatible substances to prevent chemical reactions.