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1241677-90-6 | D-Tyrosine, O-(trifluoromethyl)-
CAS No: 1241677-90-6 Catalog No: AG000LMB MDL No:MFCD07371978
Product Description
Catalog Number:
AG000LMB
Chemical Name:
D-Tyrosine, O-(trifluoromethyl)-
CAS Number:
1241677-90-6
Molecular Formula:
C10H10F3NO3
Molecular Weight:
249.1865
MDL Number:
MFCD07371978
IUPAC Name:
(2R)-2-amino-3-[4-(trifluoromethoxy)phenyl]propanoic acid
InChI:
InChI=1S/C10H10F3NO3/c11-10(12,13)17-7-3-1-6(2-4-7)5-8(14)9(15)16/h1-4,8H,5,14H2,(H,15,16)/t8-/m1/s1
InChI Key:
YZXUCQCJZKJMIR-MRVPVSSYSA-N
SMILES:
N[C@@H](C(=O)O)Cc1ccc(cc1)OC(F)(F)F
Properties
Complexity:
262
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
249.061g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
249.189g/mol
Monoisotopic Mass:
249.061g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
72.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1
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