| Weight | 112.128 g/mol |
|---|---|
| Formula | C6H8O2 |
| Hydrogen Acceptors | 2 |
| Hydrogen Donors | 0 |
| Aromatic Rings | 0 |
| Rotatable Bonds | 0 |
1,3-Cyclohexanedione (504-02-9)
Score:
#1994 in Physics
,
#6228 in Chemistry
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- Tyrosinaemia type I and NTBC (2-(2-nitro-4-trifluoromethylbenzoyl)-1,3-cyclohexanedione) (Journal of Inherited Metabolic Disease, 1998)
- Solid-state structural characterization of 1,3-cyclohexanedione and of a 6:1 cyclohexanedione-benzene cyclamer complex, a novel host-guest species (Journal of the American Chemical Society, 1986)
- From toxicological problem to therapeutic use: The discovery of the mode of action of 2-(2-nitro-4-trifluoromethylbenzoyl)-1,3-cyclohexanedione (NTBC), its toxicology and development as a drug (Journal of Inherited Metabolic Disease, 1998)
- Hepatocellular carcinoma in hereditary tyrosinemia type I despite 2-(2 nitro-4-3 trifluoro-methylbenzoyl)-1,3-cyclohexanedione treatment (Journal of Pediatric Gastroenterology and Nutrition, 2005)
- Pharmacokinetics and pharmacodynamics of NTBC (2-(2-nitro-4-fluoromethylbenzoyl)-1,3-cyclohexanedione) and mesotrione, inhibitors of 4-hydroxyphenyl pyruvate dioxygenase (HPPD) following a single dose to healthy male volunteers (British Journal of Clinical Pharmacology, 2001)
- High-pressure X-ray diffraction study on the structure and phase transition of 1,3-cyclohexanedione crystals (Acta Crystallographica Section B-structural Science, 1990)
-
Predict GHS Hazards for Any Chemical in silico.
Including Acute Oral Tox, Skin Sensitization, Eye Irritation, Aquatic Tox, & more. -
SMILESC1CC(=O)CC(=O)C1
-
InChIKeyHJSLFCCWAKVHIW-UHFFFAOYSA-N
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Similar Compounds
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1,2-CYCLOHEXANEDIONE
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2-TRIDECANONE
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2,15-Hexadecanedione
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5-Isopropyl-1,3-cyclohexanedione
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(1193-55-1)
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2-Hexanone-1,1,1,3,3-d5
(4840-82-8)
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2,3-HEPTANEDIONE
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Dimedone
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4-METHYLCYCLOHEXANONE
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(19594-40-2)
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2,5-HEXANEDIONE
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23391-99-3
(23391-99-3)
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(5432-85-9)
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1118-71-4
(1118-71-4)
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(765-69-5)
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(4233-57-2)
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(20356-92-7)
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1,3-Cyclohexanedione
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