Home Nitriles 5-(Dimethylamino)-2-(2,2,2-trifluoroacetyl)penta-2,4-dienenitrile

5-(Dimethylamino)-2-(2,2,2-trifluoroacetyl)penta-2,4-dienenitrile

CAS No.:
1022901-66-1
Catalog Number:
AG0093KE
Molecular Formula:
C9H9F3N2O
Molecular Weight:
218.1758
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
95%
In Stock USA
United States
$63
- +
1g
95%
In Stock USA
United States
$125
- +
5g
95%
In Stock USA
United States
$375
- +
Product Description
Catalog Number:
AG0093KE
Chemical Name:
5-(Dimethylamino)-2-(2,2,2-trifluoroacetyl)penta-2,4-dienenitrile
CAS Number:
1022901-66-1
Molecular Formula:
C9H9F3N2O
Molecular Weight:
218.1758
MDL Number:
MFCD22565645
IUPAC Name:
5-(dimethylamino)-2-(2,2,2-trifluoroacetyl)penta-2,4-dienenitrile
InChI:
InChI=1S/C9H9F3N2O/c1-14(2)5-3-4-7(6-13)8(15)9(10,11)12/h3-5H,1-2H3
InChI Key:
QEBYTZVFLQLFRY-UHFFFAOYSA-N
SMILES:
CN(/C=C/C=C(/C(=O)C(F)(F)F)\C#N)C
Properties
Complexity:
344  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
218.067g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
218.179g/mol
Monoisotopic Mass:
218.067g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
44.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
2  
XLogP3:
2  
Properties