L-Isoleucine, methyl ester, hydrochloride


Chemical Name: L-Isoleucine, methyl ester, hydrochloride
CAS Number: 18598-74-8
Product Number: AG00I1PX(AGN-PC-0O5GX5)
Synonyms:
MDL No: MFCD00038911
Molecular Formula: C7H16ClNO2
Molecular Weight: 181.6604

Identification/Properties


Computed Properties
Molecular Weight:
181.66g/mol
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
4
Exact Mass:
181.087g/mol
Monoisotopic Mass:
181.087g/mol
Topological Polar Surface Area:
52.3A^2
Heavy Atom Count:
11
Formal Charge:
0
Complexity:
114
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


NMR Spectrum


Other Analytical Data


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