Basic information
- CAS
104281-40-5- Standard SMILES
O=C(O)CCCCCCCCCN1C(=O)c2ccccc2C1=O- InChIKey
VMNCZZSOSFEING-UHFFFAOYSA-N- Molecular formula
- C18H23NO4
- Average molar mass
- 317.4 g/mol
- Monoisotopic mass
- 317.16270822
Names & identifiers
- Preferred name
- 10-(1,3-Dioxo-1,3-dihydro-2H-isoindol-2-yl)decanoic acid
- IUPAC
- 10-(1,3-dioxoisoindol-2-yl)decanoic acid
Names & synonyms
104281-40-5SCHEMBL607631DTXSID40545243VMNCZZSOSFEING-UHFFFAOYSA-N10-(1,3-Dioxo-1,3-dihydro-2H-isoindol-2-yl)decanoic acid10-(1,3-Dioxo-1,3-dihydroisoindol-2-yl)decanoic acid10-(1,3-Dioxo-1,3-dihydro-isoindol-2-yl)-decanoic acid10-(1,3-Dioxo-1,3-dihydroisoindol-2-yl)-decanoic acid
Database identifiers
- CAS
104281-40-5- PubChem CID
- 13622639
- DTXSID
DTXSID40545243
Properties
Computed structural properties
- XLogP
- 4.2
- Topological polar surface area
- 74.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 10
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 411
Related reactions
7 records
Compound notes
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