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Home > Fluorides > 182756-63-4
182756-63-4 | L-Tyrosine, 2,3,6-trifluoro-
CAS No: 182756-63-4 Catalog No: AG00243N MDL No:
Product Description
Catalog Number:
AG00243N
Chemical Name:
L-Tyrosine, 2,3,6-trifluoro-
CAS Number:
182756-63-4
Molecular Formula:
C9H8F3NO3
Molecular Weight:
235.1599
IUPAC Name:
(2S)-2-amino-3-(2,3,6-trifluoro-4-hydroxyphenyl)propanoic acid
InChI:
InChI=1S/C9H8F3NO3/c10-4-2-6(14)8(12)7(11)3(4)1-5(13)9(15)16/h2,5,14H,1,13H2,(H,15,16)/t5-/m0/s1
InChI Key:
LVKGBSFEYFVENX-YFKPBYRVSA-N
SMILES:
N[C@H](C(=O)O)Cc1c(F)cc(c(c1F)F)O
Properties
Complexity:
266
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
235.046g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
235.162g/mol
Monoisotopic Mass:
235.046g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
83.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.5
Literature
| Title | Journal |
|---|---|
| Deciphering radical transport in the large subunit of class I ribonucleotide reductase. | Journal of the American Chemical Society 20120118 |
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