2-keto-D-Gluconic acid
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2-keto-D-Gluconic acid
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CAS No:
669-90-9
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Formula:
C6H10O7
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Chemical Name:
2-keto-D-Gluconic acid
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Synonyms:
D-arabino-2-Hexulosonic acid;D-arabino-Hexulosonic acid;D-arabino-Hexonic acid,2-keto-;2-Ketogluconic acid;2-Oxogluconic acid;2-keto-D-Gluconic acid;D-Gluconic acid,2-keto-;D-Mannonic acid,2-keto-;D-Glucosonic acid;α-Ketogluconic acid;2-Oxo-D-gluconic acid;2-keto-Gluconic acid;2-keto-D-Gluconate;29050-77-9
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CAS No:
Description
2-dehydro-D-gluconic acid is a ketoaldonic acid that is D-gluconic acid in which the hydroxy group at position 2 has been oxidised to a keto group. It has a role as a bacterial metabolite. It derives from a D-gluconic acid. It is a conjugate acid of a 2-dehydro-D-gluconate.
Characteristics
1.757±0.06 g/cm3
152 °C
550.6±50.0 °C(Predicted)
2.10±0.54
133.43 Ų [M-H]- [CCS Type: DT, Method: stepped-field]
Computed Properties
Molecular Weight:194.14
XLogP3:-2.9
Hydrogen Bond Donor Count:5
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:5
Exact Mass:194.04265265
Monoisotopic Mass:194.04265265
Topological Polar Surface Area:135
Heavy Atom Count:13
Complexity:201
Defined Atom Stereocenter Count:3
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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