4-Thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,6-[(2,6-dimethoxybenzoyl)amino]-3,3-dimethyl-7-oxo-, monosodiumsalt, (2S,5R,6R)-


Chemical Name: 4-Thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid,6-[(2,6-dimethoxybenzoyl)amino]-3,3-dimethyl-7-oxo-, monosodiumsalt, (2S,5R,6R)-
CAS Number: 132-92-3
Product Number: AG009CJ2(AGN-PC-0PJVVI)
Synonyms:
MDL No:
Molecular Formula: C17H19N2NaO6S
Molecular Weight: 402.3973

Identification/Properties


Computed Properties
Molecular Weight:
402.397g/mol
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
7
Rotatable Bond Count:
5
Exact Mass:
402.086g/mol
Monoisotopic Mass:
402.086g/mol
Topological Polar Surface Area:
133A^2
Heavy Atom Count:
27
Formal Charge:
0
Complexity:
606
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
3
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
2
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Danger
UN#:
2811
Hazard Statements:
H315-H317-H319-H334-H335
Precautionary Statements:
P264-P280-P261-P272-P284-P271-P302+P352-P321-P332+P313-P362+P364-P333+P313-P305+P351+P338-P337+P313-P304+P340-P342+P311-P312-P403+P233-P405-P501
Class:
6.1
Packing Group:

NMR Spectrum


Other Analytical Data


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