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1-(3-Methylbut-2-enyl)-1,3-diazinane-2,4,6-trione

HCID 19904711
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Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
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Basic information

Standard SMILES
CC(C)=CCN1C(=O)CC(=O)NC1=O
InChIKey
JPZFWUYVWFHXCU-UHFFFAOYSA-N
Molecular formula
C9H12N2O3
Average molar mass
196.2 g/mol

Names & identifiers

Preferred name
1-(3-Methylbut-2-enyl)-1,3-diazinane-2,4,6-trione
IUPAC
1-(3-methylbut-2-enyl)-1,3-diazinane-2,4,6-trione

Names & synonyms

SCHEMBL9190604

Database identifiers

PubChem CID
19904711

Properties

Computed structural properties

XLogP
0.6
Topological polar surface area
66.5 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
2
Heavy atoms
14
Formal charge
0
Complexity
316

Related reactions

1 records
New reaction record
HRID 108626 reaction equation
HRID 108626As reactantTraining data from https://doi.org/10.1039/C8SC04228D (2/10)

Compound notes

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On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes