BARBITURIC ACID, 5-ALLYL-5-(p-IODOPHENYL)-
Basic information
- CAS
91718-17-1- Standard SMILES
C=CCC1(c2ccc(I)cc2)C(=O)NC(=O)NC1=O- InChIKey
TZYKWQQJCAKHQH-UHFFFAOYSA-N- Molecular formula
- C13H11IN2O3
- Average molar mass
- 370.14 g/mol
- Monoisotopic mass
- 369.98144
Names & identifiers
- Preferred name
- BARBITURIC ACID, 5-ALLYL-5-(p-IODOPHENYL)-
- IUPAC
- 5-(4-iodophenyl)-5-prop-2-enyl-1,3-diazinane-2,4,6-trione
Names & synonyms
BARBITURIC ACID, 5-ALLYL-5-(p-IODOPHENYL)-91718-17-1BRN 05448935-Allyl-5-(p-iodophenyl)barbituric acidAcido 5-allil-5-(p-iodofenil)barbiturico [Italian]Acido 5-allil-5-(p-iodofenil)barbituricoDTXSID902386785-(4-iodophenyl)-5-(prop-2-en-1-yl)-1,3-diazinane-2,4,6-trione
Database identifiers
- CAS
91718-17-1- PubChem CID
- 56287
- DTXSID
DTXSID90238678- Nikkaji
- J84.849B
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
- 408
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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