L-Isoleucine, 1,1-dimethylethyl ester, hydrochloride


Chemical Name: L-Isoleucine, 1,1-dimethylethyl ester, hydrochloride
CAS Number: 69320-89-4
Product Number: AG006GEW(AGN-PC-0OGQSW)
Synonyms:
MDL No: MFCD00058015
Molecular Formula: C10H22ClNO2
Molecular Weight: 223.7402

Identification/Properties


Properties
MP:
160 °C
Storage:
Inert atmosphere;Room Temperature;
Form:
Solid
Refractive Index:
15 ° (C=1, H2O)
Solubility:
Soluble in 50 mg/ml methanol.
Computed Properties
Molecular Weight:
223.741g/mol
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
5
Exact Mass:
223.134g/mol
Monoisotopic Mass:
223.134g/mol
Topological Polar Surface Area:
52.3A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
172
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:
2
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
N/A
Hazard Statements:
H302-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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