Home
MCP
Workbench
Skills
More
English
English
Home
Workbench
Notifications
Me
Home
/
Compound
Methyl 3-oxo-3-[(3,4,5-trimethoxy-6-methyloxan-2-yl)oxyamino]propanoate
HCID
123746194
Save
Notes
Reactions
Basic information
Names & identifiers
Properties
Related reactions
Compound notes
Substructure search
Find similar structures
Basic information
Standard SMILES
COC(=O)CC(=O)NOC1OC(C)C(OC)C(OC)C1OC
InChIKey
UJOJKXNPIQTHAD-UHFFFAOYSA-N
Molecular formula
C13H23NO8
Average molar mass
321.32 g/mol
Names & identifiers
Preferred name
Methyl 3-oxo-3-[(3,4,5-trimethoxy-6-methyloxan-2-yl)oxyamino]propanoate
IUPAC
methyl 3-oxo-3-[(3,4,5-trimethoxy-6-methyloxan-2-yl)oxyamino]propanoate
Database identifiers
PubChem CID
123746194
Properties
Computed structural properties
XLogP
-0.4
Topological polar surface area
102 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
8
Rotatable bonds
8
Heavy atoms
22
Formal charge
0
Complexity
377
Show all 8
Show all 8 / 8
Related reactions
1 records
New reaction record
All
As reactant
As product
As reagent
As catalyst
As solvent
HRID
820041
As reactant
Test data from https://doi.org/10.1039/C8SC04228D
Compound notes
Loading…