methyl 6-(1,3-benzoxazol-2-ylmethylsulfonylamino)hexanoate


Chemical Name: methyl 6-(1,3-benzoxazol-2-ylmethylsulfonylamino)hexanoate
CAS Number: 1076198-89-4
Product Number: AG007E9T(AGN-PC-05J2B1)
Synonyms:
MDL No:
Molecular Formula: C15H20N2O5S
Molecular Weight: 340.3947

Identification/Properties


Computed Properties
Molecular Weight:
340.394g/mol
XLogP3:
1.6
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
7
Rotatable Bond Count:
10
Exact Mass:
340.109g/mol
Monoisotopic Mass:
340.109g/mol
Topological Polar Surface Area:
107A^2
Heavy Atom Count:
23
Formal Charge:
0
Complexity:
477
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

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NMR Spectrum


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