1,3β,4α-Trihydroxy-5-oxocyclohexane-1β-carboxylic acid (CAS 10534-44-8) — formula C7H10O6, molecular weight 190.15; category organic chemicals.
| CAS Number | 10534-44-8 |
|---|---|
| Molecular Formula | C7H10O6 |
| Molecular Weight | 190.15 |
| LogP | -2.4 |
| Category | Organic Chemicals |
1,3β,4α-Trihydroxy-5-oxocyclohexane-1β-carboxylic acid is a carbon-based organic compound with CAS registry number 10534-44-8 and molecular formula C7H10O6 (molecular weight 190.15), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 10534-44-8
Its molecular formula C7H10O6 comprises 7 C, 10 H, 6 O atoms.
Also known as: 1,3β,4α-Trihydroxy-5-oxocyclohexane-1β-carboxylic acid · 3-脱氢奎宁酸
Category: organic chemicals
The CAS registry number of 1,3β,4α-Trihydroxy-5-oxocyclohexane-1β-carboxylic acid is 10534-44-8.
Molecular formula C7H10O6, molecular weight 190.15.
It is also registered under: 1,3β,4α-Trihydroxy-5-oxocyclohexane-1β-carboxylic acid, 3-脱氢奎宁酸.
Category: Organic Chemicals.
Independent reference data for 1,3β,4α-Trihydroxy-5-oxocyclohexane-1β-carboxylic acid (CAS 10534-44-8), compiled from public chemistry databases.
| CAS 号 | 10534-44-8 |
|---|---|
| PubChem CID | 439351 |
| 分子式 | C7H10O6 |
| IUPAC 名称 | (1R,3R,4S)-1,3,4-trihydroxy-5-oxocyclohexane-1-carboxylic acid |
| UNII（FDA） | Q8HL497GUU |
| Molecular Weight | 190.15 |
|---|---|
| XLogP3 | -2.4 |
| Hydrogen Bond Donor Count | 4 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 1 |
| Exact Mass | 190.04773803 |
| Monoisotopic Mass | 190.04773803 |
| Topological Polar Surface Area | 115 |
| Heavy Atom Count | 13 |
3-dehydroquinic acid; 5-dehydroquinic acid; 10534-44-8; (1R,3R,4S)-1,3,4-Trihydroxy-5-oxocyclohexanecarboxylic acid; Q8HL497GUU; CHEBI:17947; DTXSID50909453; RefChem:93648; DTXCID101511235; 3-dehydroquinate; (1R,3R,4S)-1,3,4-trihydroxy-5-oxocyclohexane-1-carboxylic acid; 5-dehydroquinate; UNII-Q8HL497GUU; 1,3,4-TRIHYDROXY-5-OXO-CYCLOHEXANECARBOXYLIC ACID; Cyclohexanecarboxylic acid, 1,3,4-trihydroxy-5-oxo-, (1R,3R,4S)-; Cyclohexan-1,4,5-triol-3-one-1-carboxylic acid
3-脱氢奎宁酸 · CAS 10534-44-8 · C7H10O6. UNII Q8HL497GUU.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 3-脱氢奎宁酸