Basic information
- CAS
379-32-8- Standard SMILES
CCC1(c2cccc(Cl)c2)C(=O)NC(=O)NC1=O- InChIKey
IJNIZRWRXDRLDV-UHFFFAOYSA-N- Molecular formula
- C12H11ClN2O3
- Average molar mass
- 266.68 g/mol
- Monoisotopic mass
- 266.0458199
Names & identifiers
- Preferred name
- Barbituric acid, 5-(m-chlorophenyl)-5-ethyl-
- IUPAC
- 5-(3-chlorophenyl)-5-ethyl-1,3-diazinane-2,4,6-trione
Names & synonyms
BRN 0268308BARBITURIC ACID, 5-(m-CHLOROPHENYL)-5-ETHYL-5-(m-Chlorophenyl)-5-ethyl-barbituric acid379-32-8Acido 5-(m-clorofenil)-5-etilbarbiturico [Italian]Acido 5-(m-clorofenil)-5-etilbarbituricoDTXSID001913265-24-09-00307 (Beilstein Handbook Reference)RefChem:320724DTXCID101138175-(3-chlorophenyl)-5-ethyl-1,3-diazinane-2,4,6-trione
Database identifiers
- CAS
379-32-8- PubChem CID
- 9784
- DTXSID
DTXSID00191326- Nikkaji
- J93.600F
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 75.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 377
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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