Substance
- Substance Name: di-n-octyl adipate
- Formula: C22H42O4
- Molecular Weight: 370.6 g/mol
- Identifiers:
- inchi: InChI=1S/C22H42O4/c1-3-5-7-9-11-15-19-25-21(23)17-13-14-18-22(24)26-20-16-12-10-8-6-4-2/h3-20H2,1-2H3
- inchikey: NEHDRDVHPTWWFG-UHFFFAOYSA-N
- casrn: 123-79-5
- csmiles: CCCCCCCCOC(=O)CCCCC(=O)OCCCCCCCC
- ismiles: CCCCCCCCOC(=O)CCCCC(=O)OCCCCCCCC
- pubchemId: 31271
- iupacname: dioctyl hexanedioate
- wikidataId: Q4731704
- chemspiderId: 29011
- dsstoxcmpId: DTXCID701606
- ecnumber: 204-652-9
di-n-octyl adipate
Systems and Datasets
- di-n-octyl adipate + water + 2-furaldehyde (Datasets: 1)
- Dataset 10 in paper 10.1021/acs.jced.8b00335 (Dataseries: 1, Datapoints: 8, Quantity: Mass fraction)
- 4-oxopentanoic acid + water + di-n-octyl adipate (Datasets: 1)
- Dataset 44 in paper 10.1021/acs.jced.8b00335 (Dataseries: 1, Datapoints: 1, Quantity: Mass fraction)