L-Phenylalanine, N-(3,3-dimethylbutyl)-L-a-aspartyl-, 2-methyl ester


Chemical Name: L-Phenylalanine, N-(3,3-dimethylbutyl)-L-a-aspartyl-, 2-methyl ester
CAS Number: 165450-17-9
Product Number: AG001W5N(AGN-PC-0Q8R2M)
Synonyms:
MDL No:
Molecular Formula: C20H30N2O5
Molecular Weight: 378.4626

Identification/Properties


Computed Properties
Molecular Weight:
378.469g/mol
XLogP3:
-0.1
Hydrogen Bond Donor Count:
3
Hydrogen Bond Acceptor Count:
6
Rotatable Bond Count:
12
Exact Mass:
378.215g/mol
Monoisotopic Mass:
378.215g/mol
Topological Polar Surface Area:
105A^2
Heavy Atom Count:
27
Formal Charge:
0
Complexity:
495
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
2
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
-
Hazard Statements:
H302-H315-H319-H332-H335
Precautionary Statements:
P261-P280-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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