2-[bis(carboxymethyl)amino]-6-(phenylmethoxycarbonylamino)hexanoic acid


Chemical Name: 2-[bis(carboxymethyl)amino]-6-(phenylmethoxycarbonylamino)hexanoic acid
CAS Number: 209052-01-7
Product Number: AG00C2HK(AGN-PC-0KZRDM)
Synonyms:
MDL No:
Molecular Formula: C18H24N2O8
Molecular Weight: 396.39176

Identification/Properties


Computed Properties
Molecular Weight:
396.396g/mol
XLogP3:
-0.9
Hydrogen Bond Donor Count:
4
Hydrogen Bond Acceptor Count:
9
Rotatable Bond Count:
14
Exact Mass:
396.153g/mol
Monoisotopic Mass:
396.153g/mol
Topological Polar Surface Area:
154A^2
Heavy Atom Count:
28
Formal Charge:
0
Complexity:
518
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


NMR Spectrum


Other Analytical Data


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