Basic information
- CAS
2050-63-7- Standard SMILES
CC(C)COC(=O)C(O)C(O)C(=O)OCC(C)C- InChIKey
ONZOGXRINCURBP-UHFFFAOYSA-N- Molecular formula
- C12H22O6
- Average molar mass
- 262.3 g/mol
- Monoisotopic mass
- 262.14163842
Names & identifiers
- Preferred name
- Bis(2-methylpropyl) 2,3-dihydroxybutanedioate
- IUPAC
- bis(2-methylpropyl) 2,3-dihydroxybutanedioate
Names & synonyms
diisobutyl 2,3-dihydroxysuccinateBis(2-methylpropyl) 2,3-dihydroxybutanedioateEINECS 223-763-3Tartaric acid diisobutyl esterNSC51578SCHEMBL5481281DTXSID20942675ONZOGXRINCURBP-UHFFFAOYSA-Ndiisobutyl 2,3-dihydroxybutanedioateMFCD00129104AKOS005171572NS00124119
Database identifiers
- CAS
2050-63-7、4054-82-4- PubChem CID
- 97868
- DTXSID
DTXSID20942675- Nikkaji
- J217.867B
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 93.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 9
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 246
Experimental & physicochemical properties
SpringerMaterials PropertiesBoiling point
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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