DL-Valine, N-(methoxycarbonyl)-


Chemical Name: DL-Valine, N-(methoxycarbonyl)-
CAS Number: 111398-44-8
Product Number: AG008SEV(AGN-PC-00O454)
Synonyms:
MDL No:
Molecular Formula: C7H13NO4
Molecular Weight: 175.1824

Identification/Properties


Computed Properties
Molecular Weight:
175.184g/mol
XLogP3:
0.9
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
4
Exact Mass:
175.084g/mol
Monoisotopic Mass:
175.084g/mol
Topological Polar Surface Area:
75.6A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
178
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
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#:
-
Hazard Statements:
H302-H312-H332
Precautionary Statements:
P261-P264-P270-P271-P280-P301+P312-P302+P352-P304+P340-P330-P363-P501
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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