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1269926-90-0

1269926-90-0 | L-Tyrosine, α-methyl-O-(trifluoromethyl)-

CAS No: 1269926-90-0 Catalog No: AG000WI0 MDL No:

Product Description

Catalog Number:
AG000WI0
Chemical Name:
L-Tyrosine, α-methyl-O-(trifluoromethyl)-
CAS Number:
1269926-90-0
Molecular Formula:
C11H12F3NO3
Molecular Weight:
263.2131
IUPAC Name:
(2S)-2-amino-2-methyl-3-[4-(trifluoromethoxy)phenyl]propanoic acid
InChI:
InChI=1S/C11H12F3NO3/c1-10(15,9(16)17)6-7-2-4-8(5-3-7)18-11(12,13)14/h2-5H,6,15H2,1H3,(H,16,17)/t10-/m0/s1
InChI Key:
AYWWOOCNIXIIJO-JTQLQIEISA-N
SMILES:
OC(=O)[C@](Cc1ccc(cc1)OC(F)(F)F)(N)C

Properties

Complexity:
300  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
263.077g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
263.216g/mol
Monoisotopic Mass:
263.077g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
72.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0

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