L-Valine benzyl ester, HCl


Chemical Name: L-Valine benzyl ester, HCl
CAS Number: 2462-34-2
Product Number: AG002OT9(AGN-PC-0WADMG)
Synonyms:
MDL No:
Molecular Formula: C12H18ClNO2
Molecular Weight: 243.7298

Identification/Properties


Properties
MP:
138 °C
BP:
285.5°C at 760 mmHg
Storage:
Inert atmosphere;-10 ℃;
Form:
Solid
Refractive Index:
-10 ° (C=2, H2O)
Computed Properties
Molecular Weight:
243.731g/mol
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
5
Exact Mass:
243.103g/mol
Monoisotopic Mass:
243.103g/mol
Topological Polar Surface Area:
52.3A^2
Heavy Atom Count:
16
Formal Charge:
0
Complexity:
198
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
1
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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