Octanediamide, N,N'-di-benzoyloxy-
Basic information
- CAS
959050-34-1- Standard SMILES
O=C(CCCCCCC(=O)NOC(=O)c1ccccc1)NOC(=O)c1ccccc1- InChIKey
PGGKLQYJCJJCSH-UHFFFAOYSA-N- Molecular formula
- C22H24N2O6
- Average molar mass
- 412.4 g/mol
- Monoisotopic mass
- 412.16343649
Names & identifiers
- Preferred name
- Octanediamide, N,N'-di-benzoyloxy-
- IUPAC
- [[8-(benzoyloxyamino)-8-oxooctanoyl]amino] benzoate
Names & synonyms
Octanediamide, N,N'-di-benzoyloxy-QSPL 144PGGKLQYJCJJCSH-UHFFFAOYSA-NDTXSID001367249Octanediamide, N,N'-di-benzoyloxyOctanediamide, N1,N8-bis(benzoyloxy)-959050-34-1
Database identifiers
- CAS
959050-34-1- PubChem CID
- 569846
- DTXSID
DTXSID001367249
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 111 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 13
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 518
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Compound notes
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