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ChemicalBook--->CAS DataBase List--->117482-84-5

117482-84-5

117482-84-5 Structure

117482-84-5 Structure
IdentificationMore
[Name]

3-Chloro-4-fluorobenzonitrile
[CAS]

117482-84-5
[Synonyms]

3-CHLORO-4-FLUOROBENZONITRILE
3-Chloro-4-fluorobenzonitrile 99%
3-Chloro-4-fluorobenzonitrile99%
3-Chloro-4-fluorobenzonitrile, 98+%
[EINECS(EC#)]

628-619-7
[Molecular Formula]

C7H3ClFN
[MDL Number]

MFCD00015431
[Molecular Weight]

155.56
[MOL File]

117482-84-5.mol
Chemical PropertiesBack Directory
[Appearance]

Slightly yellow crystalline powder
[Melting point ]

69-71 °C(lit.)
[Boiling point ]

135 °C / 65mmHg
[density ]

1.3760 (estimate)
[storage temp. ]

Sealed in dry,Room Temperature
[solubility ]

soluble in Methanol
[form ]

powder to crystal
[color ]

White to Almost white
[BRN ]

4740501
[InChIKey]

VAHXXQJJZKBZDX-UHFFFAOYSA-N
[CAS DataBase Reference]

117482-84-5(CAS DataBase Reference)
[NIST Chemistry Reference]

3-Chloro-4-fluorobenzonitrile(117482-84-5)
Safety DataBack Directory
[Hazard Codes ]

Xn,T,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 ]

S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S37/39:Wear suitable gloves and eye/face protection .
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection .
[RIDADR ]

3439
[WGK Germany ]

3
[Hazard Note ]

Toxic
[HazardClass ]

6.1
[PackingGroup ]

III
[HS Code ]

29269090
Hazard InformationBack Directory
[Chemical Properties]

Slightly yellow crystalline powder
[Uses]

3-Chloro-4-fluorobenzonitrile may be used in the preparation of ethyl 5-(2-chloro-4-cyanophenoxy)indoline-1-carboxylate and 3-chloro-4-(indolin-5-yloxy)benzonitrile.
[General Description]

The FTIR and Raman spectra of 3-chloro-4-fluorobenzonitrile by ab initio HF and density functional method has been reported. Reaction of 3-chloro-4-fluorobenzonitrile with potassium fluoride in 1,3-dimethylimidazolidine-2-one (DMI) has been reported.
[Toxics Screening Level]

The Initial threshold Screening Level (ITSL) is 2 μg/m3 annual average.
Spectrum DetailBack Directory
[Spectrum Detail]

3-Chloro-4-fluorobenzonitrile(117482-84-5)1HNMR
3-Chloro-4-fluorobenzonitrile(117482-84-5)Raman
3-Chloro-4-fluorobenzonitrile(117482-84-5)IR
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

3-Chloro-4-fluorobenzonitrile, 97%(117482-84-5)
[Alfa Aesar]

3-Chloro-4-fluorobenzonitrile, 98+%(117482-84-5)
[Sigma Aldrich]

117482-84-5(sigmaaldrich)
[TCI AMERICA]

3-Chloro-4-fluorobenzonitrile,>98.0%(GC)(117482-84-5)
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