L-Glutamic acid, bis(phenylmethyl) ester, 4-methylbenzenesulfonate


Chemical Name: L-Glutamic acid, bis(phenylmethyl) ester, 4-methylbenzenesulfonate
CAS Number: 2791-84-6
Product Number: AG003R9X(AGN-PC-0R3KL2)
Synonyms:
MDL No:
Molecular Formula: C26H29NO7S
Molecular Weight: 499.5760

Identification/Properties


Properties
MP:
>180°C (dec.)
BP:
453.5°C at 760 mmHg
Storage:
Inert atmosphere;Room Temperature;
Form:
Solid
Computed Properties
Molecular Weight:
499.578g/mol
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
8
Rotatable Bond Count:
11
Exact Mass:
499.166g/mol
Monoisotopic Mass:
499.166g/mol
Topological Polar Surface Area:
141A^2
Heavy Atom Count:
35
Formal Charge:
0
Complexity:
593
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-H332-H335
Precautionary Statements:
P261-P280-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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