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Methyl 3-methyl-2-(oxolane-2-carbonylamino)butanoate

HCID 19010953
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
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Basic information

Standard SMILES
COC(=O)C(NC(=O)C1CCCO1)C(C)C
InChIKey
JKSGLKGVEWWJTA-UHFFFAOYSA-N
Molecular formula
C11H19NO4
Average molar mass
229.27 g/mol

Names & identifiers

Preferred name
Methyl 3-methyl-2-(oxolane-2-carbonylamino)butanoate
IUPAC
methyl 3-methyl-2-(oxolane-2-carbonylamino)butanoate

Names & synonyms

AKOS009029285

Database identifiers

PubChem CID
19010953

Properties

Computed structural properties

XLogP
1.2
Topological polar surface area
64.6 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
5
Heavy atoms
16
Formal charge
0
Complexity
265

Related reactions

1 records
New reaction record
HRID 154833 reaction equation
HRID 154833As productTraining data from https://doi.org/10.1039/C8SC04228D (9/10)

Compound notes

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