Barbituric acid, 5-(butoxymethyl)-5-ethyl-,
Basic information
- CAS
67050-19-5- Standard SMILES
CCCCOCC1(CC)C(=O)NC(=O)NC1=O- InChIKey
RUDRTTWECOKWJP-UHFFFAOYSA-N- Molecular formula
- C11H18N2O4
- Average molar mass
- 242.27 g/mol
- Monoisotopic mass
- 242.12665706
Names & identifiers
- Preferred name
- Barbituric acid, 5-(butoxymethyl)-5-ethyl-,
- IUPAC
- 5-(butoxymethyl)-5-ethyl-1,3-diazinane-2,4,6-trione
- English name
- 5-(Butoxymethyl)-5-ethylbarbituric acid
- Molecular formula
- C11H18N2O4
- Molecular weight
- 242.27
Names & synonyms
67050-19-5BARBITURIC ACID, 5-(BUTOXYMETHYL)-5-ETHYL-,RefChem:10775965-(Butoxymethyl)-5-ethylbarbituric acidBRN 02400515-(butoxymethyl)-5-ethyl-1,3-diazinane-2,4,6-trioneDTXSID90217342Barbituric acid, 5-(butoxymethyl)-5-ethyl-5-(Butoxymethyl)-5-ethyl-2,4,6(1H,3H,5H)-pyrimidinetrione2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-(butoxymethyl)-5-ethyl-
Database identifiers
- CAS
67050-19-5- PubChem CID
- 49170
- DTXSID
DTXSID90217342- Nikkaji
- J93.524G
Properties
Computed structural properties
- XLogP
- 0.7
- Topological polar surface area
- 84.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 307
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Compound notes
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