L-Isoleucine


Chemical Name: L-Isoleucine
CAS Number: 443-79-8
Product Number: AG003PTX(AGN-PC-0OAGJX)
Synonyms:
MDL No:
Molecular Formula: C6H13NO2
Molecular Weight: 131.1729

Identification/Properties


Properties
MP:
210 °C
BP:
225.8°C at 760 mmHg
Storage:
Inert atmosphere;Room Temperature;
Form:
Solid
Computed Properties
Molecular Weight:
131.175g/mol
XLogP3:
-1.7
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
3
Exact Mass:
131.095g/mol
Monoisotopic Mass:
131.095g/mol
Topological Polar Surface Area:
63.3A^2
Heavy Atom Count:
9
Formal Charge:
0
Complexity:
103
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

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NMR Spectrum


Other Analytical Data


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