3-((tert-butoxycarbonyl)amino)-3-(o-tolyl)propanoic acid


Chemical Name: 3-((tert-butoxycarbonyl)amino)-3-(o-tolyl)propanoic acid
CAS Number: 284493-54-5
Product Number: AG007KL9(AGN-PC-0WAKYF)
Synonyms:
MDL No:
Molecular Formula: C15H21NO4
Molecular Weight: 279.3315

Identification/Properties


Computed Properties
Molecular Weight:
279.336g/mol
XLogP3:
2.3
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
6
Exact Mass:
279.147g/mol
Monoisotopic Mass:
279.147g/mol
Topological Polar Surface Area:
75.6A^2
Heavy Atom Count:
20
Formal Charge:
0
Complexity:
348
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-H315-H319-H335
Precautionary Statements:
P261-P280-P301+P312-P302+P352-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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