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96612-91-8 | 2-Amino-3-[4-(benzyloxy)phenyl]propanoic acid
CAS No: 96612-91-8 Catalog No: AG01FOE4 MDL No:
Product Description
Catalog Number:
AG01FOE4
Chemical Name:
2-Amino-3-[4-(benzyloxy)phenyl]propanoic acid
CAS Number:
96612-91-8
IUPAC Name:
2-amino-3-(4-phenylmethoxyphenyl)propanoic acid
InChI:
InChI=1S/C16H17NO3/c17-15(16(18)19)10-12-6-8-14(9-7-12)20-11-13-4-2-1-3-5-13/h1-9,15H,10-11,17H2,(H,18,19)
InChI Key:
KAFHLONDOVSENM-UHFFFAOYSA-N
NSC Number:
163630
Properties
Complexity:
294
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
271.121g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
271.316g/mol
Monoisotopic Mass:
271.121g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
72.6A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.1
Literature
| Title | Journal |
|---|---|
| N-(2-Benzoylphenyl)-L-tyrosine PPARgamma agonists. 1. Discovery of a novel series of potent antihyperglycemic and antihyperlipidemic agents. | Journal of medicinal chemistry 19981203 |
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