BARBITURIC ACID, 5-ALLYL-5-(o-CHLOROPHENYL)-
Basic information
- CAS
92022-97-4- Standard SMILES
C=CCC1(c2ccccc2Cl)C(=O)NC(=O)NC1=O- InChIKey
IMDKGLPGIKCDQD-UHFFFAOYSA-N- Molecular formula
- C13H11ClN2O3
- Average molar mass
- 278.69 g/mol
- Monoisotopic mass
- 278.0458199
Names & identifiers
- Preferred name
- BARBITURIC ACID, 5-ALLYL-5-(o-CHLOROPHENYL)-
- IUPAC
- 5-(2-chlorophenyl)-5-prop-2-enyl-1,3-diazinane-2,4,6-trione
Names & synonyms
BARBITURIC ACID, 5-ALLYL-5-(o-CHLOROPHENYL)-92022-97-4BRN 05464385-Allyl-5-(o-chlorophenyl)barbituric acidAcido 5-allil-5-(o-clorofenil)barbiturico [Italian]Acido 5-allil-5-(o-clorofenil)barbituricoDTXSID802388295-(2-chlorophenyl)-5-(prop-2-en-1-yl)-1,3-diazinane-2,4,6-trione
Database identifiers
- CAS
92022-97-4- PubChem CID
- 56314
- DTXSID
DTXSID80238829- Nikkaji
- J84.823I
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 75.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 416
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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