N-(Methoxycarbonyl)-D-Valine


Chemical Name: N-(Methoxycarbonyl)-D-Valine
CAS Number: 171567-86-5
Product Number: AG0039UF(AGN-PC-0WAJHR)
Synonyms:
MDL No:
Molecular Formula: C7H13NO4
Molecular Weight: 175.1824

Identification/Properties


Computed Properties
Molecular Weight:
175.18g/mol
XLogP3:
0.9
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
4
Exact Mass:
175.084458g/mol
Monoisotopic Mass:
175.084458g/mol
Topological Polar Surface Area:
75.6Ų
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
178
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:
1
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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