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Home Fluorides 1170613-55-4
1170613-55-4,MFCD20488058
Catalog No.:AA000DK6

1170613-55-4 | (1E,3E)-1-(4-Fluorophenyl)-2-methyl-1-penten-3-one oxime

Pack Size
Purity
Availability
Price(USD)
Quantity
  
5mg
≥98%
in stock  
$93.00   $65.00
- +
10mg
≥98%
in stock  
$173.00   $121.00
- +
25mg
≥98%
in stock  
$409.00   $286.00
- +
50mg
in stock  
$702.00   $492.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA000DK6
Chemical Name:
(1E,3E)-1-(4-Fluorophenyl)-2-methyl-1-penten-3-one oxime
CAS Number:
1170613-55-4
Molecular Formula:
C12H14FNO
Molecular Weight:
207.2441
MDL Number:
MFCD20488058
SMILES:
CC/C(=N\O)/C(=C/c1ccc(cc1)F)/C
Properties
Properties
 
Form:
Solid  
Storage:
2-8℃;  

Computed Properties
 
Complexity:
252  
Covalently-Bonded Unit Count:
1  
Defined Bond Stereocenter Count:
2  
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
3  
XLogP3:
3.2  

Downstream Synthesis Route

[1]CurrentPatentAssignee:ABBVIEINC-US9108905,2015,B2

Literature

Title: Selective blockade of TRPA1 channel attenuates pathological pain without altering noxious cold sensation or body temperature regulation.

Journal: Pain 20110501

Title: McGaraughty S, et al. TRPA1 modulation of spontaneous and mechanically evoked firing of spinal neurons in uninjured, osteoarthritic, and inflamed rats. Mol Pain. 2010 Mar 5;6:14.

Quotation Request
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Additional Info:
SDS
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Tags:1170613-55-4 Molecular Formula|1170613-55-4 MDL|1170613-55-4 SMILES|1170613-55-4 (1E,3E)-1-(4-Fluorophenyl)-2-methyl-1-penten-3-one oxime