Dicyclohexyl 2,3-dihydroxybutanedioate
Basic information
- CAS
15785-59-8- Standard SMILES
O=C(OC1CCCCC1)C(O)C(O)C(=O)OC1CCCCC1- InChIKey
UXHUJQMSTNOTRT-UHFFFAOYSA-N- Molecular formula
- C16H26O6
- Average molar mass
- 314.37 g/mol
- Monoisotopic mass
- 314.17293854
Names & identifiers
- Preferred name
- Dicyclohexyl 2,3-dihydroxybutanedioate
- IUPAC
- dicyclohexyl 2,3-dihydroxybutanedioate
Names & synonyms
15785-59-8Butanedioic acid, 2,3-dihydroxy-, dicyclohexyl esterdicyclohexyl 2,3-dihydroxybutanedioateSCHEMBL9052523DTXSID20935825UXHUJQMSTNOTRT-UHFFFAOYSA-NAKOS000277797AKOS028113762NS00052052
Database identifiers
- CAS
15785-59-8- PubChem CID
- 85907
- DTXSID
DTXSID20935825- EC Number
- 239-883-4
- Nikkaji
- J248.765I
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 93.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 7
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 335
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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