D-Tyrosine, phenylmethyl ester, mono(4-methylbenzenesulfonate) (salt)


Chemical Name: D-Tyrosine, phenylmethyl ester, mono(4-methylbenzenesulfonate) (salt)
CAS Number: 97984-63-9
Product Number: AG006AEE(AGN-PC-0W7RMC)
Synonyms:
MDL No:
Molecular Formula: C23H25NO6S
Molecular Weight: 443.5127

Identification/Properties


Properties
Storage:
Inert atmosphere;Room Temperature;
Form:
Solid
Computed Properties
Molecular Weight:
443.514g/mol
Hydrogen Bond Donor Count:
3
Hydrogen Bond Acceptor Count:
7
Rotatable Bond Count:
7
Exact Mass:
443.14g/mol
Monoisotopic Mass:
443.14g/mol
Topological Polar Surface Area:
135A^2
Heavy Atom Count:
31
Formal Charge:
0
Complexity:
500
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
1
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
2
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
N/A
Hazard Statements:
H302-H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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Chemical Structure



The (R)-Benzyl 2-amino-3-(4-hydroxyphenyl)propanoate 4-methylbenzenesulfonate is a versatile compound widely utilized in chemical synthesis as a key building block for the creation of various organic molecules. It serves as a crucial intermediate in the formation of pharmaceuticals, agrochemicals, and fine chemicals. This compound plays a significant role in the development of asymmetric synthesis strategies, offering a chiral center that enables the production of optically active compounds. Additionally, its unique structural properties make it an essential component in the synthesis of biologically active molecules with potential therapeutic applications.