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368426-86-2

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368426-86-2 Structure

368426-86-2 Structure
IdentificationBack Directory
[Name]

5-(Aminomethyl)-2-fluorobenzonitrile
[CAS]

368426-86-2
[Synonyms]

3-Cyano-4-fluorobenzylamine
5-(aminomethyl)-2-fluorobenzonitrile
Benzonitrile, 5-(aminomethyl)-2-fluoro-
3-Cyano-4-fluorobenzylamine hydrochloride
Benzonitrile, 5-(aminomethyl)-2-fluoro- (9CI)
5-(AMINOMETHYL)-2-FLUOROBENZONITRILE(WX191678)
[Molecular Formula]

C8H7FN2
[MDL Number]

MFCD09908197
[MOL File]

368426-86-2.mol
[Molecular Weight]

150.15
Chemical PropertiesBack Directory
[Boiling point ]

264.2°C
[density ]

1.20
[Fp ]

114°C
[storage temp. ]

under inert gas (nitrogen or Argon) at 2–8 °C
[form ]

solid
[pka]

8.51±0.10(Predicted)
[Appearance]

Colorless to off-white Solid-Liquid Mixture
[InChI]

1S/C8H7FN2/c9-8-2-1-6(4-10)3-7(8)5-11/h1-3H,4,10H2
[InChIKey]

VRSKZZIXPDVEFN-UHFFFAOYSA-N
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H335-H319-H315
[Precautionary statements ]

P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362
[Hazard Codes ]

Xi
[WGK Germany ]

WGK 3
[HS Code ]

2926907090
[Storage Class]

11 - Combustible Solids
[Hazard Classifications]

Eye Irrit. 2
Skin Irrit. 2
Skin Sens. 1
Hazard InformationBack Directory
[Uses]

5-Aminomethyl-2-fluorobenzonitrile is used in the synthesis thrombin inhibitors containing P3-heterocycles with P1-bicyclic arginine surrogates.
Spectrum DetailBack Directory
[Spectrum Detail]

5-(Aminomethyl)-2-fluorobenzonitrile(368426-86-2)1HNMR
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