Cas no 28057-58-1 (D-erythro-2,3-Hexodiulose(8CI,9CI))
28057-58-1 structure
Product Name:D-erythro-2,3-Hexodiulose(8CI,9CI)
CAS No:28057-58-1
MF:C6H10O6
MW:178.140002727509
CID:255778
PubChem ID:147194
Update Time:2025-04-19
D-erythro-2,3-Hexodiulose(8CI,9CI) Chemical and Physical Properties
Names and Identifiers
-
- (4R,5R)-1,4,5,6-tetrahydroxyhexane-2,3-dione
- D-erythro-2,3-Hexodiulose(8CI,9CI)
- D-erythro-2,3-Hexodiulose
- DTXSID00182335
- 3-Ketofructose
- erythro-hexo-2,3-diulose
- 28057-58-1
-
- Inchi： 1S/C6H10O6/c7-1-3(9)5(11)6(12)4(10)2-8/h3,5,7-9,11H,1-2H2/t3-,5-/m1/s1
- InChI Key： ZJLNMPGCXVVXDR-NQXXGFSBSA-N
- SMILES： O[C@H](CO)[C@H](C(C(CO)=O)=O)O
Computed Properties
- Exact Mass: 178.048
- Monoisotopic Mass: 178.048
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 4
- Hydrogen Bond Acceptor Count: 6
- Heavy Atom Count: 12
- Rotatable Bond Count: 5
- Complexity: 177
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 2
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: -3
- Topological Polar Surface Area: 115?2
Experimental Properties
- Density: 1.582
- Boiling Point: 463.1°Cat760mmHg
- Flash Point: 248°C
- Refractive Index: 1.551
D-erythro-2,3-Hexodiulose(8CI,9CI) Related Literature
-
1. The photochemistry of ketones derived from carbohydrates. Part 8. Type I cleavage of 1,2:4,5-di-O-isopropylidene-β-D-erythro-2,3-hexodiulose-2,6-pyranose: a synthesis of D-ribulose from D-fructosePeter M. Collins,Paul Gupta,Anthony S. Travis J. Chem. Soc. Perkin Trans. 1 1980 277
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