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Home Aminos 1,1,1-Trifluoro-4-(isopropylamino)pent-3-en-2-one

1,1,1-Trifluoro-4-(isopropylamino)pent-3-en-2-one

CAS No.:
127223-95-4
Catalog Number:
AG000WSI
Molecular Formula:
C8H12F3NO
Molecular Weight:
195.1822
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
95%
1 week
United States
$114
- +
1g
95%
1 week
United States
$267
- +
Product Description
Catalog Number:
AG000WSI
Chemical Name:
1,1,1-Trifluoro-4-(isopropylamino)pent-3-en-2-one
CAS Number:
127223-95-4
Molecular Formula:
C8H12F3NO
Molecular Weight:
195.1822
MDL Number:
MFCD04116477
IUPAC Name:
1,1,1-trifluoro-4-(propan-2-ylamino)pent-3-en-2-one
InChI:
InChI=1S/C8H12F3NO/c1-5(2)12-6(3)4-7(13)8(9,10)11/h4-5,12H,1-3H3
InChI Key:
BKNFRFGKUBBQME-UHFFFAOYSA-N
SMILES:
CC(N/C(=C\C(=O)C(F)(F)F)/C)C
Properties
Complexity:
218  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
195.087g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
195.185g/mol
Monoisotopic Mass:
195.087g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1  
XLogP3:
3  
Properties