Basic information
- CAS
85018-92-4- Standard SMILES
CCC(C)(CCCCCCCCC(C)(CC)C(=O)O)C(=O)O- InChIKey
IWZAMHOGQRTLIT-UHFFFAOYSA-N- Molecular formula
- C18H34O4
- Average molar mass
- 314.5 g/mol
- Monoisotopic mass
- 314.24570956
Names & identifiers
- Preferred name
- 2,11-Diethyl-2,11-dimethyldodecanedioic acid
- IUPAC
- 2,11-diethyl-2,11-dimethyldodecanedioic acid
- English name
- Dodecanedioic acid, 2,11-diethyl-2,11-dimethyl-
- Molecular formula
- C18H34O4
- Molecular weight
- 314.46
Names & synonyms
2,11-Diethyl-2,11-dimethyldodecanedioic acid85018-92-4DTXSID201005372RefChem:1058806DTXCID801432256Dodecanedioic acid, 2,11-diethyl-2,11-dimethyl-
Database identifiers
- CAS
85018-92-4- PubChem CID
- 3069697
- DTXSID
DTXSID201005372
Properties
Computed structural properties
- XLogP
- 5.8
- Topological polar surface area
- 74.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 13
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 319
Physicochemical properties
- EWG's Food Scores
- 1 · 1
Chemistry & industry
Suppliers1 total
HONEST JOY HOLDINGS LIMITED[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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