Basic information
- CAS
1330-92-3- Standard SMILES
CCCCC(CC)COC(=O)C1=C(C(=O)OCC(CC)CCCC)CCCC1- InChIKey
ZVPBHZIVOWGPMT-UHFFFAOYSA-N- Molecular formula
- C24H42O4
- Average molar mass
- 394.6 g/mol
- Monoisotopic mass
- 394.30830982
Names & identifiers
- Preferred name
- Cyclohexene-1,2-dicarboxylic acid, bis(2-ethylhexyl) ester
- IUPAC
- bis(2-ethylhexyl) cyclohexene-1,2-dicarboxylate
- English name
- Di(2ethylhexyl)tetrahydrophthalate
- Molecular weight
- 0
Names & synonyms
1330-92-3Cyclohexene-1,2-dicarboxylic acid, bis(2-ethylhexyl) esterRefChem:1082620bis(2-ethylhexyl) cyclohexene-1,2-dicarboxylatedi(2ethylhexyl)tetrahydrophthalateDi(2-ethylhexyl) tetrahydrophthalatebis(2-ethylhexyl) cyclohex-1-ene-1,2-dicarboxylateSCHEMBL29558205DTXSID90927898bis(2-ethylhexyl) cyclohexene-1,2-dicar-boxylateDI-(2-ETHYLHEXYL)TETREHYDROPHTHALATE
Database identifiers
- CAS
1330-92-3- PubChem CID
- 94201
- DTXSID
DTXSID90927898- Nikkaji
- J77.854K
Properties
Computed structural properties
- XLogP
- 7.9
- Topological polar surface area
- 52.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 16
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 451
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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