L-Isoleucine, N-methyl-N-(phenylmethyl)-


Chemical Name: L-Isoleucine, N-methyl-N-(phenylmethyl)-
CAS Number: 4125-97-7
Product Number: AG00BZT9(AGN-PC-0OAAR1)
Synonyms:
MDL No:
Molecular Formula: C14H21NO2
Molecular Weight: 235.3220

Identification/Properties


Computed Properties
Molecular Weight:
235.327g/mol
XLogP3:
0.8
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
6
Exact Mass:
235.157g/mol
Monoisotopic Mass:
235.157g/mol
Topological Polar Surface Area:
40.5A^2
Heavy Atom Count:
17
Formal Charge:
0
Complexity:
236
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-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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