Home Other Building Blocks 2-phenyl-2-(trifluoroacetamido)acetic acid

2-phenyl-2-(trifluoroacetamido)acetic acid

CAS No.:
39801-62-2
Catalog Number:
AG01AV3V
Molecular Formula:
C10H8F3NO3
Molecular Weight:
247.1706
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Product Description
Catalog Number:
AG01AV3V
Chemical Name:
2-phenyl-2-(trifluoroacetamido)acetic acid
CAS Number:
39801-62-2
Molecular Formula:
C10H8F3NO3
Molecular Weight:
247.1706
MDL Number:
MFCD00442501
IUPAC Name:
2-phenyl-2-[(2,2,2-trifluoroacetyl)amino]acetic acid
InChI:
InChI=1S/C10H8F3NO3/c11-10(12,13)9(17)14-7(8(15)16)6-4-2-1-3-5-6/h1-5,7H,(H,14,17)(H,15,16)
InChI Key:
AFPBGEGBLXHXNY-UHFFFAOYSA-N
SMILES:
OC(=O)C(c1ccccc1)NC(=O)C(F)(F)F
Properties
Complexity:
298  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
247.046g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
247.173g/mol
Monoisotopic Mass:
247.046g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
66.4A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9  
Properties