Butanoic acid, 3,4-diamino-4-oxo-, (3S)-


Chemical Name: Butanoic acid, 3,4-diamino-4-oxo-, (3S)-
CAS Number: 28057-52-5
Product Number: AG00C13X(AGN-PC-0O8JUK)
Synonyms:
MDL No:
Molecular Formula: C4H8N2O3
Molecular Weight: 132.1179

Identification/Properties


Computed Properties
Molecular Weight:
132.119g/mol
XLogP3:
-4.5
Hydrogen Bond Donor Count:
3
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
3
Exact Mass:
132.053g/mol
Monoisotopic Mass:
132.053g/mol
Topological Polar Surface Area:
106A^2
Heavy Atom Count:
9
Formal Charge:
0
Complexity:
134
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#:
-
Hazard Statements:
H302-H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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