Home Other Building Blocks (S)-2-AMINO-3-(6-FLUORO-1H-INDOL-3-YL)-PROPIONIC ACID

(S)-2-AMINO-3-(6-FLUORO-1H-INDOL-3-YL)-PROPIONIC ACID

CAS No.:
19310-00-0
Catalog Number:
AG00AC1E
Molecular Formula:
C11H11FN2O2
Molecular Weight:
222.2156
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Product Description
Catalog Number:
AG00AC1E
Chemical Name:
(S)-2-AMINO-3-(6-FLUORO-1H-INDOL-3-YL)-PROPIONIC ACID
CAS Number:
19310-00-0
Molecular Formula:
C11H11FN2O2
Molecular Weight:
222.2156
MDL Number:
MFCD00137731
IUPAC Name:
(2S)-2-amino-3-(6-fluoro-1H-indol-3-yl)propanoic acid
InChI:
InChI=1S/C11H11FN2O2/c12-7-1-2-8-6(3-9(13)11(15)16)5-14-10(8)4-7/h1-2,4-5,9,14H,3,13H2,(H,15,16)/t9-/m0/s1
InChI Key:
YMEXGEAJNZRQEH-VIFPVBQESA-N
SMILES:
OC(=O)[C@H](Cc1c[nH]c2c1ccc(c2)F)N
UNII:
WB5L1P9TZO
Properties
Complexity:
275  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
222.08g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
222.219g/mol
Monoisotopic Mass:
222.08g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
79.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.8  
Literature
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Properties