2,9-Diethyl-2,9-dimethyldecanedioic acid
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Basic information
- CAS
85018-88-8- Standard SMILES
CCC(C)(CCCCCCC(C)(CC)C(=O)O)C(=O)O- InChIKey
LXRXTKJTPPFGFN-UHFFFAOYSA-N- Molecular formula
- C16H30O4
- Average molar mass
- 286.41 g/mol
- Monoisotopic mass
- 286.21440943
Names & identifiers
- Preferred name
- 2,9-Diethyl-2,9-dimethyldecanedioic acid
- IUPAC
- 2,9-diethyl-2,9-dimethyldecanedioic acid
- English name
- 2,9-Diethyl-2,9-dimethyldecanedioic acid
- Molecular formula
- C16H30O4
- Molecular weight
- 286.41
Names & synonyms
2,9-Diethyl-2,9-dimethyldecanedioic acid85018-88-8DTXSID801005368RefChem:1060415DTXCID001432252Decanedioic acid, 2,9-diethyl-2,9-dimethyl-SCHEMBL11091604LXRXTKJTPPFGFN-UHFFFAOYSA-N2,9-diethyl-2,9-dimethyl-1,10-decanedioic acid
Database identifiers
- CAS
85018-88-8- PubChem CID
- 3069693
- DTXSID
DTXSID801005368
Properties
Computed structural propertiesFilling in
- XLogP
- 4.7
- Topological polar surface area
- 74.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 11
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 294
Related reactions
1 records
Compound notes
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