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5-Butyl-5-(hydroxymethyl)imidazolidine-2,4-dione

HCID 348565
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Basic information

CAS
7507-22-4
Standard SMILES
CCCCC1(CO)NC(=O)NC1=O
InChIKey
SJVKKDWMDLBFCC-UHFFFAOYSA-N
Molecular formula
C8H14N2O3
Average molar mass
186.21 g/mol
Monoisotopic mass
186.10044231

Names & identifiers

Preferred name
5-Butyl-5-(hydroxymethyl)imidazolidine-2,4-dione
IUPAC
5-butyl-5-(hydroxymethyl)imidazolidine-2,4-dione

Names & synonyms

7507-22-45-butyl-5-(hydroxymethyl)imidazolidine-2,4-dioneNSC407946SCHEMBL1983591DTXSID00324894NSC-407946

Database identifiers

CAS
7507-22-4
PubChem CID
348565
DTXSID
DTXSID00324894

Properties

Computed structural properties

XLogP
0.5
Topological polar surface area
78.4 Ų
Hydrogen bond donors
3
Hydrogen bond acceptors
3
Rotatable bonds
4
Heavy atoms
13
Formal charge
0
Complexity
229

Related reactions

1 records
New reaction record
HRID 1146065 reaction equation
HRID 1146065As reactantTraining data from https://doi.org/10.1039/C8SC04228D (7/10)

Compound notes

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