CID9862251 structure

CID9862251

(2R,3Z,5R)-3-(2-hydroxyethylidene)-7-oxo-4-oxa-1-azabicyclo[3.2.0]heptane-2-carboxylate;2,4,4-trimethylpentan-2-ylazanium

Also Known As: (2R,3Z,5R)-3-(2-hydroxyethylidene)-7-oxo-4-oxa-1-azabicyclo[3.2.0]heptane-2-carboxylate;2,4,4-trimethylpentan-2-ylazanium

CAS: 66069-32-7
Molecular Formula C16H28N2O5
Molecular Weight 328.19983 g/mol
LogP -0.9872
Topological Polar Surface Area 117.54 Ų
Hydrogen Bond Donors 2
Hydrogen Bond Acceptors 5
Rotatable Bonds 3
Exact Mass 328.19983
Monoisotopic Mass 328.19983
Heavy Atoms 23
Complexity 475.6795

Chemical Identifiers

CAS Number 66069-32-7
SMILES CC(C)(C)CC(C)(C)[NH3+].C1[C@@H]2N(C1=O)[C@H](/C(=C/CO)/O2)C(=O)[O-]

Product Overview

CID9862251 (CAS 66069-32-7), with molecular formula C16H28N2O5 and molecular weight 328.19983 g/mol. IUPAC: (2R,3Z,5R)-3-(2-hydroxyethylidene)-7-oxo-4-oxa-1-azabicyclo[3.2.0]heptane-2-carboxylate;2,4,4-trimethylpentan-2-ylazanium.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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