ChemicalBook--->CAS DataBase List--->13989-82-7

13989-82-7

13989-82-7 Structure

13989-82-7 Structure
IdentificationBack Directory
[Name]

4-(DIMETHYLAMINO)BUTYRONITRILE
[CAS]

13989-82-7
[Synonyms]

NSC 163159
4-(DIMETHYLAMINO)BUTYRONITRILE
4-Dimethylaminobutyronitrile >
Butanenitrile, 4-(dimethylamino)-
[EINECS(EC#)]

237-788-2
[Molecular Formula]

C6H12N2
[MDL Number]

MFCD00019892
[MOL File]

13989-82-7.mol
[Molecular Weight]

112.17
Chemical PropertiesBack Directory
[Boiling point ]

85°C/ 25mm
[density ]

0.874±0.06 g/cm3 (20 ºC 760 Torr)
[refractive index ]

1.4276 (589.3 nm 20℃)
[Fp ]

60.0±11.9℃
[storage temp. ]

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

clear liquid
[pka]

9.04±0.28(Predicted)
[color ]

Colorless to Almost colorless
Safety DataBack Directory
[Hazard Codes ]

C
[RIDADR ]

UN 1993 3/PG III
[HazardClass ]

CORROSIVE
[PackingGroup ]

III
[HS Code ]

2926907090
Hazard InformationBack Directory
[Uses]

4-(Dimethylamino)benzonitrile(DMABN) can be used in the synthesis of 3,6-diphenyl-2,5-dihydro-pyrrolo[3,4-c]pyrrole-1,4-dione derivatives. DMABN is also used in photophysical studies due to its ability to undergo intramolecular charge transfer (ICT) from the dimethylamino moiety to the cyanophenyl moiety on photo-excitation leading to the appearance of dual fluorescence.
[References]

[1] ATTILA DEMETER Klaas A Z. Fluorescence of crystalline 4-(dimethylamino)benzonitrile. Absence of dual fluorescence and observation of single-exponential fluorescence decays[J]. Chemical Physics Letters, 2003, 380 5: Pages 699-703. DOI:10.1016/j.cplett.2003.09.073.
[2] JUSTIN M. RHINEHART David W M J Reddy Challa. Multimode Charge-Transfer Dynamics of 4-(Dimethylamino)benzonitrile Probed with Ultraviolet Femtosecond Stimulated Raman Spectroscopy[J]. The Journal of Physical Chemistry B, 2012, 116 35: 10522-10534. DOI:10.1021/jp3020645.
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