Home Aminos 1-(2-aminophenyl)-2-methylprop-2-en-1-one, trifluoroacetic acid

1-(2-aminophenyl)-2-methylprop-2-en-1-one, trifluoroacetic acid

CAS No.:
1803605-37-9
Catalog Number:
AG01B9R2
Molecular Formula:
C12H12F3NO3
Molecular Weight:
275.2238
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Product Description
Catalog Number:
AG01B9R2
Chemical Name:
1-(2-aminophenyl)-2-methylprop-2-en-1-one, trifluoroacetic acid
CAS Number:
1803605-37-9
Molecular Formula:
C12H12F3NO3
Molecular Weight:
275.2238
MDL Number:
MFCD28383962
IUPAC Name:
1-(2-aminophenyl)-2-methylprop-2-en-1-one;2,2,2-trifluoroacetic acid
InChI:
InChI=1S/C10H11NO.C2HF3O2/c1-7(2)10(12)8-5-3-4-6-9(8)11;3-2(4,5)1(6)7/h3-6H,1,11H2,2H3;(H,6,7)
InChI Key:
FIJMVSLKVQMPEK-UHFFFAOYSA-N
SMILES:
OC(=O)C(F)(F)F.CC(=C)C(=O)c1ccccc1N
Properties
Complexity:
281  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
275.077g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
275.227g/mol
Monoisotopic Mass:
275.077g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
80.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties