L-Isoleucine, 4-hydroxy-


Chemical Name: L-Isoleucine, 4-hydroxy-
CAS Number: 781658-23-9
Product Number: AG003LJI(AGN-PC-0OI43M)
Synonyms:
MDL No:
Molecular Formula: C6H13NO3
Molecular Weight: 147.1723

Identification/Properties


Properties
MP:
>200 °C
BP:
331.6 °C at 760 mmHg
Storage:
Inert atmosphere;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
147.174g/mol
XLogP3:
-2.8
Hydrogen Bond Donor Count:
3
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
3
Exact Mass:
147.09g/mol
Monoisotopic Mass:
147.09g/mol
Topological Polar Surface Area:
83.6A^2
Heavy Atom Count:
10
Formal Charge:
0
Complexity:
126
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
2
Undefined Atom Stereocenter Count:
1
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#:
N/A
Hazard Statements:
H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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