Home Aminos 2-amino-3,3,3-trifluoro-2-(3-fluorophenyl)propanoic acid

2-amino-3,3,3-trifluoro-2-(3-fluorophenyl)propanoic acid

CAS No.:
1341562-07-9
Catalog Number:
AG01A3TW
Molecular Formula:
C9H7F4NO2
Molecular Weight:
237.1510
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Product Description
Catalog Number:
AG01A3TW
Chemical Name:
2-amino-3,3,3-trifluoro-2-(3-fluorophenyl)propanoic acid
CAS Number:
1341562-07-9
Molecular Formula:
C9H7F4NO2
Molecular Weight:
237.1510
MDL Number:
MFCD19653969
IUPAC Name:
2-amino-3,3,3-trifluoro-2-(3-fluorophenyl)propanoic acid
InChI:
InChI=1S/C9H7F4NO2/c10-6-3-1-2-5(4-6)8(14,7(15)16)9(11,12)13/h1-4H,14H2,(H,15,16)
InChI Key:
NUXDDYNJOVNZHY-UHFFFAOYSA-N
SMILES:
Fc1cccc(c1)C(C(F)(F)F)(C(=O)O)N
Properties
Complexity:
281  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
237.041g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
237.154g/mol
Monoisotopic Mass:
237.041g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
63.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.7  
Properties