(6R)-7-amino-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid


Chemical Name: (6R)-7-amino-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
CAS Number: 26395-99-3
Product Number: AG002T1B(AGN-PC-00MPUX)
Synonyms:
MDL No:
Molecular Formula: C8H10N2O3S
Molecular Weight: 214.2416

Identification/Properties


Computed Properties
Molecular Weight:
214.239g/mol
XLogP3:
-3.1
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
1
Exact Mass:
214.041g/mol
Monoisotopic Mass:
214.041g/mol
Topological Polar Surface Area:
109A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
353
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
2
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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