Basic information
- CAS
669-90-9- Standard SMILES
O=C(O)C(=O)C(O)C(O)C(O)CO- InChIKey
VBUYCZFBVCCYFD-UHFFFAOYSA-N- Molecular formula
- C6H10O7
- Average molar mass
- 194.14 g/mol
- Monoisotopic mass
- 194.04265265
Overview
2-Keto-L-gluconate is a hexose.
Names & identifiers
- Preferred name
- 2-Hexulosonic acid
- IUPAC
- 3,4,5,6-tetrahydroxy-2-oxohexanoic acid
- English name
- 2-oxogluconic acid
- Molecular formula
- C6H10O7
- Molecular weight
- 194.14
Names & synonyms
2-hexulosonic acid73803-83-5RefChem:935473GlyTouCan:G46363QKG46363QK2-keto-L-gluconate2-Keto-L-galactonic acid91548-32-2(3R,4S,5R)-3,4,5,6-tetrahydroxy-2-oxohexanoic acidD-arabino-Hexulosonic acidGluconic acid, 2-oxo-2-keto-D-gluconate
Show more names
fructonic acid2-oxogluconic acid2-Oxo-D-gluconic acidCoenzyme A Impurity 82-dehydro-D-gluconicaciAscorbic Acid Impurity 282-dehydro-D-gluconic acidD-Arabino-2-hexulosonic acid2-Keto-d-gluconic Acid Sodium2-Oxo-2-deoxy-D-gluconic acid
773WWQ6UFE3,4,5,6-tetrahydroxy-2-oxohexanoic acid2-Ketoidonate2-KetogluconsaureEINECS 211-574-9UNII-773WWQ6UFESCHEMBL2903691CHEBI:88378
Database identifiers
- CAS
669-90-9、73803-83-5、91548-32-2
Properties
Computed structural properties
- XLogP
- -2.9
- Topological polar surface area
- 135 Ų
- Hydrogen bond donors
- 5
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 5
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 201
Experimental & physicochemical properties
Physical DescriptionSolid
Physicochemical properties
- Melting point
- 152 °C · 152 °C
- Boiling point
- 550.6 · 550.6±50.0 °C(Predicted)
- Density
- 1.757 · 1.757±0.06 g/cm3(Predicted)
- storage temp.
- 2 · Storage temp. 2-8°C
- solubility
- DMSO (Slightly), Water (Slightly)
- form
- Solid
- pka
- 2.1 · 2.10±0.54(Predicted)
- color
- Off-White to Pale Brown
- FDA UNII
- 773 WWQ6UFE · 773WWQ6UFE
- EPA Substance Registry System
- -2 · D-arabino-2-Hexulosonic acid (669-90-9)
- TSCA
- TSCA listed
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- tsca
- TSCA listed
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Downstream products
Suppliers17 total
艾吉析科技（上海）有限公司17717235263 · [email protected]
上海瀚鸿科技股份有限公司021-54306202 13764082696 · [email protected]
上海皓鸿生物医药科技有限公司400-8210725 4008210725 · [email protected]
湖北扬信医药科技有限公司15347293736 · [email protected]
深圳菲斯生物科技有限公司0755-83725350 13380397412 · [email protected]
深圳振强药物研发有限公司+86-0755-66853366 +86-13670046396 · [email protected]
北京秦岭医药科技有限公司010-61241352 18901327973 · [email protected]
上海艾康睿医药科技有限公司021-33730573 15821573036 · [email protected]
杭州洁汉化工有限公司+86-571-86217390; +8618058761490 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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