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Basic information
- CAS
6345-92-2- Standard SMILES
CCCCCCCCCC(C)C(C(=O)OCC)C(=O)OCC- InChIKey
CAXCFFGCYDHFGP-UHFFFAOYSA-N- Molecular formula
- C18H34O4
- Average molar mass
- 314.5 g/mol
- Monoisotopic mass
- 314.24570957
Names & identifiers
- Preferred name
- Diethyl undecan-2-ylpropanedioate
- IUPAC
- diethyl 2-undecan-2-ylpropanedioate
Names & synonyms
6345-92-2diethyl undecan-2-ylpropanedioateNSC43730DTXSID00286084CAXCFFGCYDHFGP-UHFFFAOYSA-NDiethyl (undecan-2-yl)propanedioateNSC-43730Diethyl(2-n-nonylpropanedicarboxylate)
Database identifiers
- CAS
6345-92-2- PubChem CID
- 239016
- DTXSID
DTXSID00286084
Properties
Computed structural propertiesFilling in
- XLogP
- 6.6
- Topological polar surface area
- 52.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 15
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 283
Related reactions
1 records
Compound notes
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