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ChemicalBook--->CAS DataBase List--->1170613-55-4

1170613-55-4

1170613-55-4 Structure

1170613-55-4 Structure
IdentificationBack Directory
[Name]

A 967079
[CAS]

1170613-55-4
[Synonyms]

A 967079
(1E,3E)-1-(4-Fluorophenyl)-2-Methyl-1-penten-3-one oxiMe
(1E,3E)-1-(4-Fluorophenyl)-2-methyl-1-pentene-3-one oxime
1-Penten-3-one, 1-(4-fluorophenyl)-2-methyl-, oxime, (1E,3E)-
TRP Channel,inhibit,Transient receptor potential channels,A 967079,Inhibitor,A-967079,A967079
[Molecular Formula]

C12H14FNO
[MDL Number]

MFCD20488058
[MOL File]

1170613-55-4.mol
[Molecular Weight]

207.24
Chemical PropertiesBack Directory
[Boiling point ]

324.4±34.0 °C(Predicted)
[density ]

1.03±0.1 g/cm3 (20 ºC 760 Torr)
[storage temp. ]

2-8°C
[solubility ]

DMSO: ≥12mg/mL
[form ]

powder
[pka]

12.23±0.40(Predicted)
[color ]

white to tan
[Stability:]

Stable for 2 years from date of purchase as supplied. Solutions in DMSO may be stored at -20°C for up to 2 months
[InChI]

InChI=1S/C12H14FNO/c1-3-12(14-15)9(2)8-10-4-6-11(13)7-5-10/h4-8,15H,3H2,1-2H3/b9-8+,14-12+
[InChIKey]

HKROEBDHHKMNBZ-CHBKHGQFSA-N
[SMILES]

C(/C1=CC=C(F)C=C1)=C(/C)\C(=N\O)\CC
Safety DataBack Directory
[WGK Germany ]

3
[HS Code ]

2928009090
Hazard InformationBack Directory
[Description]

A-967079 (1170613-55-4) is a TRPA1 blocker. Active in rat models.1 Cell permeable
[Uses]

(1E,3E)- 1-(4-Fluorophenyl)-2-methyl-1-penten-3-one Oxime is a transient receptor potential ankyrin 1 (TRPA1) antagonist and has been investigated as potential analgesic drug for the treatment of chronic pain.
[Uses]

A-967079 has been used in blocking miR-711-induced TRPA1 (transient receptor potential cation channel subfamily A member 1) channel.
[General Description]

A-967079 prevents neuropathic and inflammatory pain. It reduces cold allodynia, which is produced by nerve injury.
[Biochem/physiol Actions]

A-967079 is a potent and selective antagonist of Transient Receptor Potential Anykrin 1 (TRPA1) with IC50′s of 67 nM and 289 nM at human and rat TRPA1 receptors, respectively, and minimal or no activity at other TRP channels or G-protein-coupled receptors, enzymes, transporters, and ion channels out of 89 tested. A-967079 blocks TRPA1 activation in human and rat cell lines and has been shown to reduce the responses of wide dynamic range (WDR) and nociceptive specific (NS) neurons to high-intensity mechanical stimulation.
[storage]

Store at -20°C
[References]

1) McGaraughty et al. (2010), TRPA1 modulation of spontaneous and mechanically evoked firing of spinal neurons in uninjured, osteoarthritic, and inflamed rats; Mol. Pain, 6 14.
Spectrum DetailBack Directory
[Spectrum Detail]

A 967079(1170613-55-4)1HNMR
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