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1596-67-4

1596-67-4 | L-Tyrosine, O-(4-hydroxyphenyl)-

CAS No: 1596-67-4 Catalog No: AG001R86 MDL No:MFCD00063070

Product Description

Catalog Number:
AG001R86
Chemical Name:
L-Tyrosine, O-(4-hydroxyphenyl)-
CAS Number:
1596-67-4
Molecular Formula:
C15H15NO4
Molecular Weight:
273.2839
MDL Number:
MFCD00063070
IUPAC Name:
(2S)-2-amino-3-[4-(4-hydroxyphenoxy)phenyl]propanoic acid
InChI:
InChI=1S/C15H15NO4/c16-14(15(18)19)9-10-1-5-12(6-2-10)20-13-7-3-11(17)4-8-13/h1-8,14,17H,9,16H2,(H,18,19)/t14-/m0/s1
InChI Key:
KKCIOUWDFWQUBT-AWEZNQCLSA-N
SMILES:
OC(=O)[C@H](Cc1ccc(cc1)Oc1ccc(cc1)O)N
EC Number:
216-483-8
UNII:
E4QN8G00CV

Properties

Complexity:
307  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
273.1g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
273.288g/mol
Monoisotopic Mass:
273.1g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
92.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.7  

Literature

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