3-(acetyloxymethyl)-8-oxo-7-[(2-pyridin-2-ylsulfanylacetyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid

Modify Date: 2025-08-25 11:38:22

3-(acetyloxymethyl)-8-oxo-7-[(2-pyridin-2-ylsulfanylacetyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid Structure
3-(acetyloxymethyl)-8-oxo-7-[(2-pyridin-2-ylsulfanylacetyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid structure
Common Name 3-(acetyloxymethyl)-8-oxo-7-[(2-pyridin-2-ylsulfanylacetyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
CAS Number 21593-22-6 Molecular Weight 423.46300
Density 1.57g/cm3 Boiling Point 783.9ºC at 760 mmHg
Molecular Formula C17H17N3O6S2 Melting Point N/A
MSDS N/A Flash Point 427.9ºC

 Names

Name 3-(acetyloxymethyl)-8-oxo-7-[(2-pyridin-2-ylsulfanylacetyl)amino]-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid

 Chemical & Physical Properties

Density 1.57g/cm3
Boiling Point 783.9ºC at 760 mmHg
Molecular Formula C17H17N3O6S2
Molecular Weight 423.46300
Flash Point 427.9ºC
Exact Mass 423.05600
PSA 176.50000
LogP 0.80420
Vapour Pressure 6.98E-26mmHg at 25°C
Index of Refraction 1.688
InChIKey HTQGXEDPVLPVPW-UHFFFAOYSA-N
SMILES CC(=O)OCC1=C(C(=O)O)N2C(=O)C(NC(=O)CSc3ccccn3)C2SC1
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