Butanoic acid, 3-oxo-4-[[(phenylmethoxy)carbonyl]amino]-, methyl ester


Chemical Name: Butanoic acid, 3-oxo-4-[[(phenylmethoxy)carbonyl]amino]-, methyl ester
CAS Number: 82961-77-1
Product Number: AG003RTV(AGN-PC-0NK77E)
Synonyms:
MDL No: MFCD08067417
Molecular Formula: C13H15NO5
Molecular Weight: 265.2619

Identification/Properties


Properties
MP:
49-51℃
BP:
414.4±35.0°C at 760 mmHg
Storage:
Keep in dry area;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
265.265g/mol
XLogP3:
1.2
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
8
Exact Mass:
265.095g/mol
Monoisotopic Mass:
265.095g/mol
Topological Polar Surface Area:
81.7A^2
Heavy Atom Count:
19
Formal Charge:
0
Complexity:
323
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
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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