Cas no 78579-61-0 (2,2,6,6-Tetramethyl-3,5-octanedione)
78579-61-0 structure
Product Name:2,2,6,6-Tetramethyl-3,5-octanedione
CAS No:78579-61-0
MF:C12H22O2
MW:198.301884174347
MDL:MFCD02684546
CID:562727
PubChem ID:18668031
Update Time:2025-04-19
2,2,6,6-Tetramethyl-3,5-octanedione Chemical and Physical Properties
Names and Identifiers
-
- 2,2,6,6-Tetramethyloctane-3,5-dione
- 2,2,6,6-Tetramethyl-3,5-octanedione
- 3,5-Octanedione,2,2,6,6-tetramethyl-
- 3,5-Octanedione,2,2,6,6-tetramethyl
- TMOD
- 2,2,6,6-tetramethyloctane3,5-dione
- CS-0086876
- AMY11773
- 2-Butanol, 3,3-dimethyl-, 2-benzoate
- DTXSID90595410
- 78579-61-0
- SCHEMBL406290
- MFCD02684546
-
- MDL： MFCD02684546
- Inchi： 1S/C12H22O2/c1-7-12(5,6)10(14)8-9(13)11(2,3)4/h7-8H2,1-6H3
- InChI Key： UZICKDIYFALSHI-UHFFFAOYSA-N
- SMILES： O=C(CC(C(C)(C)C)=O)C(C)(C)CC
Computed Properties
- Exact Mass: 198.16200
- Monoisotopic Mass: 198.161979940g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 14
- Rotatable Bond Count: 5
- Complexity: 231
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Surface Charge: 0
- Tautomer Count: 3
- XLogP3: 3
- Topological Polar Surface Area: 34.1?2
Experimental Properties
- Color/Form: 。
- Density: 0.897±0.06 g/cm3 (20 oC 760 Torr),
- Melting Point: Not available
- Boiling Point: 259.3±13.0 oC (760 Torr),
- Flash Point: 95.7±16.8 oC,
- Solubility: Very slightly soluble (0.52 g/l) (25 o C),
- PSA: 34.14000
- LogP: 2.99700
- Solubility: 。
- Vapor Pressure: 0.0±0.5 mmHg at 25°C
2,2,6,6-Tetramethyl-3,5-octanedione Security Information
- Signal Word：warning
- Hazard Statement： H303+H313+H333
- Warning Statement： P264+P280+P305+P351+P338+P337+P313
- Hazard Category Code： 36/37/38
- Safety Instruction： S26; S36/37/39
- Safety Term：26-36/37/39
- Risk Phrases：R36/37/38
- Storage Condition：storage at -4℃ (1-2weeks), longer storage period at -20℃ (1-2years)
2,2,6,6-Tetramethyl-3,5-octanedione Customs Data
- HS CODE：2914190090
- Customs Data：
China Customs Code:
2914190090Overview:
2914190090 Other acyclic ketones without other oxygen-containing groups.Regulatory conditions:nothing.VAT:17.0%.Tax refund rate:9.0%.MFN tariff:5.5%.general tariff:30.0%
Declaration elements:
Product Name, component content, use to, Acetone declared packaging
Summary:
2914190090 other acyclic ketones without other oxygen function.Supervision conditions:None.VAT:17.0%.Tax rebate rate:9.0%.MFN tariff:5.5%.General tariff:30.0%
2,2,6,6-Tetramethyl-3,5-octanedione Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| SHANG HAI XIAN DING Biotechnology Co., Ltd. | 08-2100-5g |
2,2,6,6-Tetramethyl-3,5-octanedione,98%(TMOD) |
78579-61-0 | 98%(TMOD) | 5g |
3078CNY | 2021-05-08 | |
| SHANG HAI XIAN DING Biotechnology Co., Ltd. | 08-2100-1g |
2,2,6,6-Tetramethyl-3,5-octanedione,98%(TMOD) |
78579-61-0 | 98%(TMOD) | 1g |
769CNY | 2021-05-08 | |
| SU ZHOU XIN JIA YUAN HUA XUE Technology Co., Ltd. | 600636-5g |
2,2,6,6-Tetramethyl-3,5-octanedione |
78579-61-0 | 98% | 5g |
￥2800.0 | 2024-07-19 | |
| SU ZHOU XIN JIA YUAN HUA XUE Technology Co., Ltd. | 600636-1g |
2,2,6,6-Tetramethyl-3,5-octanedione |
78579-61-0 | 98% | 1g |
￥700.0 | 2024-07-19 | |
| abcr | AB130802-1 g |
2,2,6,6-Tetramethyl-3,5-octanedione, 98% (TMOD); . |
78579-61-0 | 98% | 1 g |
€70.80 | 2023-07-20 | |
| abcr | AB130802-5 g |
2,2,6,6-Tetramethyl-3,5-octanedione, 98% (TMOD); . |
78579-61-0 | 98% | 5 g |
€251.00 | 2023-07-20 | |
| SHANG HAI XIAN DING Biotechnology Co., Ltd. | 08-2100-5g |
2,2,6,6-Tetramethyl-3,5-octanedione,98%(TMOD) |
78579-61-0 | 98%(TMOD) | 5g |
3078.0CNY | 2021-07-12 | |
| SHANG HAI XIAN DING Biotechnology Co., Ltd. | 08-2100-1g |
2,2,6,6-Tetramethyl-3,5-octanedione,98%(TMOD) |
78579-61-0 | 98%(TMOD) | 1g |
769.0CNY | 2021-07-12 | |
| TRC | T890328-10mg |
2,2,6,6-Tetramethyl-3,5-octanedione |
78579-61-0 | 10mg |
$ 50.00 | 2022-06-02 | ||
| TRC | T890328-50mg |
2,2,6,6-Tetramethyl-3,5-octanedione |
78579-61-0 | 50mg |
$ 65.00 | 2022-06-02 |
2,2,6,6-Tetramethyl-3,5-octanedione Related Literature
-
James D. Kirkham,Patrick M. Delaney,George J. Ellames,Eleanor C. Row,Joseph P. A. Harrity Chem. Commun., 2010,46, 5154-5156
-
J. M. Granadino-Roldán,M. Fernández-Gómez,A. Navarro,T. Pe?a Ruiz,U. A. Jayasooriya Phys. Chem. Chem. Phys., 2004,6, 1133-1143
-
Jialiang Yuan,Ran Dong,Yuan Li,Yang Liu,Zhuo Zheng,Yuxia Liu,Yan Sun,Benhe Zhong,Zhenguo Wu,Xiaodong Guo Chem. Commun., 2021,57, 13004-13007
-
Andre Prates Pereira,Tao Dong,Eric P. Knoshaug,Nick Nagle,Ryan Spiller,Bonnie Panczak,Christopher J. Chuck,Philip T. Pienkos Sustainable Energy Fuels, 2020,4, 3400-3408
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