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Compound
Methyl 4-methyl-2-(prop-2-enoxycarbonylamino)pentanoate
HCID
22910329
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Basic information
Standard SMILES
C=CCOC(=O)NC(CC(C)C)C(=O)OC
InChIKey
QFQGNBYZXZRPBP-UHFFFAOYSA-N
Molecular formula
C11H19NO4
Average molar mass
229.27 g/mol
Names & identifiers
Preferred name
Methyl 4-methyl-2-(prop-2-enoxycarbonylamino)pentanoate
IUPAC
methyl 4-methyl-2-(prop-2-enoxycarbonylamino)pentanoate
Names & synonyms
SCHEMBL7269272
AKOS009090335
Database identifiers
PubChem CID
22910329
Properties
Computed structural properties
XLogP
2.2
Topological polar surface area
64.6 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
8
Heavy atoms
16
Formal charge
0
Complexity
250
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Related reactions
1 records
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As reactant
As product
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As solvent
HRID
155824
As product
Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Compound notes
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