ChemicalBook--->CAS DataBase List--->372-39-4

372-39-4

372-39-4 Structure

372-39-4 Structure
IdentificationMore
[Name]

3,5-Difluoroaniline
[CAS]

372-39-4
[Synonyms]

3,5-DIFLUOROANILINE
3,5-DIFLUOROBENZENAMINE
3,5-Difluoroaniline(AntibacterialAntiphlogistic,WeedKiller)(C6H5F2N)
3,5-Difluoroaniline,98%
3,5-Difluoroaniline 98%
3,5-DIFLUOROBENZENEAMINE
Benzenamine, 3,5-difluoro
3,5-Difluoronitroaniline
3,5-Difluorophenylamine
[EINECS(EC#)]

206-752-8
[Molecular Formula]

C6H5F2N
[MDL Number]

MFCD00007763
[Molecular Weight]

129.11
[MOL File]

372-39-4.mol
Chemical PropertiesBack Directory
[Appearance]

white to yellowish low melting solid
[Melting point ]

37-41 °C (lit.)
[Boiling point ]

80°C 20mm
[density ]

1,295 g/cm3
[refractive index ]

1,512-1,514
[Fp ]

167 °F
[storage temp. ]

Keep in dark place,Sealed in dry,Room Temperature
[Water Solubility ]

Insoluble in water
[form ]

Low Melting Solid
[pka]

2.57±0.10(Predicted)
[color ]

White to yellow
[BRN ]

2802286
[InChI]

InChI=1S/C6H5F2N/c7-4-1-5(8)3-6(9)2-4/h1-3H,9H2
[InChIKey]

KQOIBXZRCYFZSO-UHFFFAOYSA-N
[SMILES]

C1(N)=CC(F)=CC(F)=C1
[CAS DataBase Reference]

372-39-4(CAS DataBase Reference)
[EPA Substance Registry System]

372-39-4(EPA Substance)
Questions And AnswerBack Directory
[Synthesis]

Work on halogenated benzenes has also demonstrated the versatility of this technique and a variety of fluoro-chloro and -bromo benzenes may be de-brominated and de-chlorinated. Two patents describe removal of chlorine from 2,6-dichloro-3,5- difluoronitrobenzene giving 3,5-difluoroaniline. Synthesis of 3,5-Difluoroaniline
Safety DataBack Directory
[Hazard Codes ]

Xn,Xi
[Risk Statements ]

R20/21/22:Harmful by inhalation, in contact with skin and if swallowed .
R36/37/38:Irritating to eyes, respiratory system and skin .
[Safety Statements ]

S28:After contact with skin, wash immediately with plenty of ... (to be specified by the manufacturer) .
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection .
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36:Wear suitable protective clothing .
[RIDADR ]

UN 1325 4.1/PG 2
[WGK Germany ]

3
[F ]

8-10-23
[Hazard Note ]

Irritant
[TSCA ]

Yes
[HazardClass ]

6.1
[PackingGroup ]

III
[HS Code ]

29214200
[Storage Class]

11 - Combustible Solids
[Hazard Classifications]

Acute Tox. 4 Dermal
Acute Tox. 4 Inhalation
Acute Tox. 4 Oral
Raw materials And Preparation ProductsBack Directory
[Raw materials]

1-Bromo-3,5-difluorobenzene-->N-benzyl-3,5-difluoroaniline-->Hydrogen-->Methanol-->Activated carbon-->Palladium-->Sulfuric acid
[Preparation Products]

2,4-dibromo-1,3,5-trifluorobenzene-->4-AMINO-2,6-DIFLUORO-BENZALDEHYDE-->2,4,6-Trifluorochlorobenzene-->2-AMINO-4,6-DIFLUOROBENZOIC ACID-->3,5-Difluoro-4-iodoaniline-->3,5-DIFLUOROBENZENESULFONAMIDE-->N-Methyl 3,5-difluoroaniline-->1,3,5-Trifluorobenzene-->N-(3,5-Difluorophenyl)-4-nitrobenzenesulfonaMide, 97%-->Benzenamine, 3,5-difluoro-N,N-dimethyl- (9CI)-->N-(3,5-Difluorophenyl)-4-fluorobenzaMide, 97%-->2-(3,5-Difluorophenoxy)acetic acid-->5,7-Difluoro-4-hydroxyquinoline-3-carboxylic acid ethyl ester
Material Safety Data Sheet(MSDS)Back Directory
[msds information]

3,5-Difluorobenzenamine(372-39-4).msds
Hazard InformationBack Directory
[Chemical Properties]

white to yellowish low melting solid
[Uses]

3,5-Difluoroaniline has been used in the preparation of 3,5-difluorodimethylaniline.
[Application]

3,5-Difluoroaniline is mainly used as a key intermediate in the synthesis of complex organic molecules such as pharmaceuticals (e.g., antibacterial drugs, anti-inflammatory drugs), pesticides (e.g., herbicides), and dyes.
[General Description]

In vitro nephrotoxic effects of 3,5-difluoroaniline has been investigated in renal cortical slices obtained from the kidneys of untreated, male Fischer 344 rats.
[References]

[1] Patent: CN108314624, 2018, A. Location in patent: Paragraph 0054; 0055; 0056; 0057
Spectrum DetailBack Directory
[Spectrum Detail]

3,5-Difluoroaniline(372-39-4)MS
3,5-Difluoroaniline(372-39-4)1HNMR
3,5-Difluoroaniline(372-39-4)13CNMR
3,5-Difluoroaniline(372-39-4)IR1
3,5-Difluoroaniline(372-39-4)IR2
3,5-Difluoroaniline(372-39-4)Raman
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

3,5-Difluoroaniline, 98%(372-39-4)
[Alfa Aesar]

3,5-Difluoroaniline, 98+%(372-39-4)
[Sigma Aldrich]

372-39-4(sigmaaldrich)
[TCI AMERICA]

3,5-Difluoroaniline,>97.0%(GC)(372-39-4)
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