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


Chemical Name: 5-Thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid,3-[(acetyloxy)methyl]-7-amino-8-oxo-, (6R,7R)-
CAS Number: 957-68-6
Product Number: AG003NCV(AGN-PC-0W5DY2)
Synonyms:
MDL No:
Molecular Formula: C10H12N2O5S
Molecular Weight: 272.2777

Identification/Properties


Properties
MP:
>300 °C(lit.)
Storage:
Light sensitive;Keep in dry area;Room Temperature;
Form:
Solid
Refractive Index:
1.5650 (estimate)
Computed Properties
Molecular Weight:
272.275g/mol
XLogP3:
-4
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
7
Rotatable Bond Count:
4
Exact Mass:
272.047g/mol
Monoisotopic Mass:
272.047g/mol
Topological Polar Surface Area:
135A^2
Heavy Atom Count:
18
Formal Charge:
0
Complexity:
461
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
2
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#:
-
Hazard Statements:
H302-H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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