Cas no 68113-55-3 (2-Pentanone, 1-hydroxy-4-methyl-)
68113-55-3 structure
Product Name:2-Pentanone, 1-hydroxy-4-methyl-
CAS No:68113-55-3
MF:C6H12O2
MW:116.158282279968
CID:393692
PubChem ID:13294594
Update Time:2025-09-22
2-Pentanone, 1-hydroxy-4-methyl- Chemical and Physical Properties
Names and Identifiers
-
- 2-Pentanone, 1-hydroxy-4-methyl-
- 1-hydroxy-4-methylpentan-2-one
- 1-Hydroxy-4-methyl-2-pentanone
- LogP
- Q1V1Y1&
- EN300-370711
- SCHEMBL359488
- FEMA No. 4463
- NS00022671
- 60PZB594QD
- UNII-60PZB594QD
- DTXSID60218306
- Q27263244
- Oxymethylisobutylketon
- 68113-55-3
- CHEBI:195499
-
- Inchi： 1S/C6H12O2/c1-5(2)3-6(8)4-7/h5,7H,3-4H2,1-2H3
- InChI Key： ARVGGOVEVYSUPQ-UHFFFAOYSA-N
- SMILES： O=C(CO)CC(C)C
Computed Properties
- Exact Mass: 116.08376
- Monoisotopic Mass: 116.083729621g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 8
- Rotatable Bond Count: 3
- Complexity: 76.6
- 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
- XLogP3: 0.6
- Topological Polar Surface Area: 37.3?2
Experimental Properties
- PSA: 37.3
2-Pentanone, 1-hydroxy-4-methyl- Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| Enamine | EN300-370711-0.05g |
1-hydroxy-4-methylpentan-2-one |
68113-55-3 | 90% | 0.05g |
$245.0 | 2023-05-30 | |
| Enamine | EN300-370711-0.1g |
1-hydroxy-4-methylpentan-2-one |
68113-55-3 | 90% | 0.1g |
$366.0 | 2023-05-30 | |
| Enamine | EN300-370711-0.25g |
1-hydroxy-4-methylpentan-2-one |
68113-55-3 | 90% | 0.25g |
$524.0 | 2023-05-30 | |
| Enamine | EN300-370711-0.5g |
1-hydroxy-4-methylpentan-2-one |
68113-55-3 | 90% | 0.5g |
$824.0 | 2023-05-30 | |
| Enamine | EN300-370711-1.0g |
1-hydroxy-4-methylpentan-2-one |
68113-55-3 | 90% | 1g |
$1057.0 | 2023-05-30 | |
| Enamine | EN300-370711-2.5g |
1-hydroxy-4-methylpentan-2-one |
68113-55-3 | 90% | 2.5g |
$2071.0 | 2023-05-30 | |
| Enamine | EN300-370711-5.0g |
1-hydroxy-4-methylpentan-2-one |
68113-55-3 | 90% | 5g |
$3065.0 | 2023-05-30 | |
| Enamine | EN300-370711-10.0g |
1-hydroxy-4-methylpentan-2-one |
68113-55-3 | 90% | 10g |
$4545.0 | 2023-05-30 | |
| Enamine | EN300-2980234-0.1g |
1-hydroxy-4-methylpentan-2-one |
68113-55-3 | 86.0% | 0.1g |
$366.0 | 2025-03-18 | |
| Enamine | EN300-2980234-5.0g |
1-hydroxy-4-methylpentan-2-one |
68113-55-3 | 86.0% | 5.0g |
$3065.0 | 2025-03-18 |
2-Pentanone, 1-hydroxy-4-methyl- Related Literature
-
Long Deng,Qian Zou,Biao Liu,Wenhui Ye,Chengfei Zhuo,Li Chen,Ze-Yuan Deng,Ya-Wei Fan,Jing Li Food Funct., 2018,9, 4234-4245
-
Olga Guselnikova,Gérard Audran,Jean-Patrick Joly,Andrii Trelin,Evgeny V. Tretyakov,Vaclav Svorcik,Oleksiy Lyutakov,Sylvain R. A. Marque Chem. Sci., 2021,12, 4154-4161
-
Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
-
Hanie Hashtroudi,Ian D. R. Mackinnon J. Mater. Chem. C, 2020,8, 13108-13126
-
Chao-Han Cheng,Wen-Zhen Wang,Shie-Ming Peng,I-Chia Chen Phys. Chem. Chem. Phys., 2017,19, 25471-25477
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