Basic information
- CAS
53334-58-0- Standard SMILES
NC(=O)C12CC3(C(N)=O)CC(C(N)=O)(CC(C(N)=O)(C1)C3=O)C2=O- InChIKey
IBMMNWZLAHPJEX-UHFFFAOYSA-N- Molecular formula
- C14H16N4O6
- Average molar mass
- 336.3 g/mol
- Monoisotopic mass
- 336.10698424
Names & identifiers
- Preferred name
- Tricyclo(3.3.1.1(sup 3,7))decane-1,3,5,7-tetracarboxamide, 2,6-dioxo-
- IUPAC
- 2,6-dioxoadamantane-1,3,5,7-tetracarboxamide
Names & synonyms
53334-58-0BRN 26804292,6-Adamantanedione-1,3,5,7-tetracarboxylic acid amideTricyclo(3.3.1.1(sup 3,7))decane-1,3,5,7-tetracarboxamide, 2,6-dioxo-DTXSID70201486RefChem:385962DTXCID701239772,6-dioxoadamantane-1,3,5,7-tetracarboxamideSTL324703AKOS0221338212,6-dioxo-1,3,5,7-adamantanetetracarboxamideAE-641/11815106
Show more names
2,6-dioxotricyclo[3.3.1.1~3,7~]decane-1,3,5,7-tetracarboxamide(1R,3R,5R,7R)-2,6-DIOXOADAMANTANE-1,3,5,7-TETRACARBOXAMIDE
Database identifiers
- CAS
53334-58-0- PubChem CID
- 64375
- DTXSID
DTXSID70201486
Properties
Computed structural properties
- XLogP
- -2.7
- Topological polar surface area
- 207 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 4
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 629
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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