L-Alanine, 2-propenyl ester, 4-methylbenzenesulfonate


Chemical Name: L-Alanine, 2-propenyl ester, 4-methylbenzenesulfonate
CAS Number: 20845-17-4
Product Number: AG002JPF(AGN-PC-0QWOF9)
Synonyms:
MDL No:
Molecular Formula: C13H19NO5S
Molecular Weight: 301.3587

Identification/Properties


Computed Properties
Molecular Weight:
301.357g/mol
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
6
Rotatable Bond Count:
5
Exact Mass:
301.098g/mol
Monoisotopic Mass:
301.098g/mol
Topological Polar Surface Area:
115A^2
Heavy Atom Count:
20
Formal Charge:
0
Complexity:
318
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


NMR Spectrum


Other Analytical Data


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