Home Other Building Blocks (2S)-3-hydroxy-2-(trifluoroacetamido)propanoic acid

(2S)-3-hydroxy-2-(trifluoroacetamido)propanoic acid

CAS No.:
1428-32-6
Catalog Number:
AG01C6J0
Molecular Formula:
C5H6F3NO4
Molecular Weight:
201.1006
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Product Description
Catalog Number:
AG01C6J0
Chemical Name:
(2S)-3-hydroxy-2-(trifluoroacetamido)propanoic acid
CAS Number:
1428-32-6
Molecular Formula:
C5H6F3NO4
Molecular Weight:
201.1006
MDL Number:
MFCD12795795
IUPAC Name:
(2S)-3-hydroxy-2-[(2,2,2-trifluoroacetyl)amino]propanoic acid
InChI:
InChI=1S/C5H6F3NO4/c6-5(7,8)4(13)9-2(1-10)3(11)12/h2,10H,1H2,(H,9,13)(H,11,12)/t2-/m0/s1
InChI Key:
MNZSUGIBHJBDRX-REOHCLBHSA-N
SMILES:
OC[C@@H](C(=O)O)NC(=O)C(F)(F)F
Properties
Complexity:
214  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
201.025g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
201.101g/mol
Monoisotopic Mass:
201.025g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
86.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.4  
Properties