Basic information
- CAS
26272-53-7- Standard SMILES
CCCCCCCCCOC(=O)c1ccccc1C(=O)OCCCCC- InChIKey
UOJVLBHTWYCQJE-UHFFFAOYSA-N- Molecular formula
- C22H34O4
- Average molar mass
- 362.5 g/mol
- Monoisotopic mass
- 362.24570956
Names & identifiers
- Preferred name
- Phthalic acid, nonyl pentyl ester
- IUPAC
- 2-O-nonyl 1-O-pentyl benzene-1,2-dicarboxylate
Names & synonyms
Phthalic acid, nonyl pentyl esterNonyl pentyl phthalateUOJVLBHTWYCQJE-UHFFFAOYSA-NDTXSID901015900Nonyl pentyl benzene-1,2-dicarboxylate26272-53-7
Database identifiers
- CAS
26272-53-7- PubChem CID
- 6423391
- DTXSID
DTXSID901015900
Properties
Computed structural properties
- XLogP
- 8
- Topological polar surface area
- 52.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 16
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 380
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…