Basic information
- Standard SMILES
O=C(O)CCC(=O)OC(C1CO1)C(OC(=O)CCC(=O)O)C1CO1- InChIKey
XIAXRHKFOAGSES-UHFFFAOYSA-N- Molecular formula
- C14H18O10
- Average molar mass
- 346.29 g/mol
- Monoisotopic mass
- 346.08999678
Overview
structure given in first source
Names & identifiers
- Preferred name
- 3,4-Disuccinyl 1,2-5,6-dianhydrogalactitol
- IUPAC
- 4-[2-(3-carboxypropanoyloxy)-1,2-bis(oxiran-2-yl)ethoxy]-4-oxobutanoic acid
- English name
- 3,4-disuccinyl 1,2-5,6-dianhydrogalactitol
- Molecular formula
- C14H18O10
- Molecular weight
- 346.29
Names & synonyms
3,4-Disuccinyldianhydrogalactitol66913-57-33,4-Disuccinyl 1,2-5,6-dianhydrogalactitol1,2-5,6-dianhydrogalactitol bis(hydrogen butanedioate)RefChem:91240DTXSID20985582Galactitol, 1,2:5,6-dianhydro-, bis(hemisuccinate)NSC3494394-[2-(3-carboxypropanoyloxy)-1,2-bis(oxiran-2-yl)ethoxy]-4-oxobutanoic acidNSC 349439NSC-349439Galactitol,2:5,6-dianhydro-, bis(hydrogen butanedioate)
Show more names
Galactitol, 1,2:5,6-dianhydro-, bis(hydrogen butanedioate) (9CI)
1,2:5,6-dianhydro-3,4-bis-O-(3-carboxypropanoyl)hexitol
Database identifiers
- CAS
66913-57-3- PubChem CID
- 100156
- DTXSID
DTXSID20985582
Properties
Computed structural properties
- XLogP
- -1.6
- Topological polar surface area
- 152 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 10
- Rotatable bonds
- 13
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 470
Related reactions
0 records
No reaction records under the current filter.
Linked notes
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