Cas no 21884-26-4 (Pentanoic acid, 4-oxo-,1-methylethyl ester)
21884-26-4 structure
Product Name:Pentanoic acid, 4-oxo-,1-methylethyl ester
CAS No:21884-26-4
MF:C8H14O3
MW:158.194962978363
CID:257211
Update Time:2025-04-19
Pentanoic acid, 4-oxo-,1-methylethyl ester Chemical and Physical Properties
Names and Identifiers
-
- Pentanoic acid, 4-oxo-,1-methylethyl ester
- isopropyl 4-oxovalerate
- propan-2-yl 4-oxopentanoate
- iso-Propyl levulinate
-
- Inchi： 1S/C8H14O3/c1-6(2)11-8(10)5-4-7(3)9/h6H,4-5H2,1-3H3
- InChI Key： MGJRGGIHFUREHT-UHFFFAOYSA-N
- SMILES： CC(OC(CCC(=O)C)=O)C
Computed Properties
- Exact Mass: 158.09432
- Monoisotopic Mass: 158.094
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 11
- Rotatable Bond Count: 5
- Complexity: 149
- 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
- Topological Polar Surface Area: 43.4A^2
Experimental Properties
- Density: 0.9842
- Boiling Point: 209.3°C (estimate)
- Flash Point: 84.4°C
- Refractive Index: 1.4420
- PSA: 43.37
- LogP: 1.30720
Pentanoic acid, 4-oxo-,1-methylethyl ester Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| SHANG HAI MAI KE LIN SHENG HUA Technology Co., Ltd. | I906492-1g |
isopropyl 4-oxovalerate |
21884-26-4 | 97% | 1g |
￥3,200.00 | 2022-01-11 | |
| Chemenu | CM243627-1g |
Isopropyl 4-oxopentanoate |
21884-26-4 | 97% | 1g |
$*** | 2023-03-29 | |
| SHANG HAI MAI KE LIN SHENG HUA Technology Co., Ltd. | I906492-250mg |
isopropyl 4-oxovalerate |
21884-26-4 | 97% | 250mg |
￥1,268.00 | 2022-01-11 | |
| SHANG HAI MAI KE LIN SHENG HUA Technology Co., Ltd. | I906492-5g |
isopropyl 4-oxovalerate |
21884-26-4 | 97% | 5g |
￥9,680.00 | 2022-01-11 | |
| SHANG HAI MAI KE LIN SHENG HUA Technology Co., Ltd. | I906492-bulk |
isopropyl 4-oxovalerate |
21884-26-4 | 97% | bulk |
￥POA | 2022-01-11 | |
| 1PlusChem | 1P00BGD2-250mg |
isopropyl 4-oxovalerate |
21884-26-4 | 97% | 250mg |
$192.00 | 2023-12-18 | |
| 1PlusChem | 1P00BGD2-1g |
isopropyl 4-oxovalerate |
21884-26-4 | 97% | 1g |
$477.00 | 2023-12-18 | |
| 1PlusChem | 1P00BGD2-5g |
isopropyl 4-oxovalerate |
21884-26-4 | 97% | 5g |
$1434.00 | 2023-12-18 | |
| A2B Chem LLC | AF33622-250mg |
Isopropyl 4-oxopentanoate |
21884-26-4 | 97% | 250mg |
$210.00 | 2024-04-20 | |
| A2B Chem LLC | AF33622-1g |
Isopropyl 4-oxopentanoate |
21884-26-4 | 97% | 1g |
$527.00 | 2024-04-20 |
Pentanoic acid, 4-oxo-,1-methylethyl ester Related Literature
-
Abhinav Kumar,Rajendra Srivastava Sustainable Energy Fuels 2019 3 2475
-
Satheesh Ellipilli,John D. Phillips,Jennifer M. Heemstra Org. Biomol. Chem. 2018 16 4659
21884-26-4 (Pentanoic acid, 4-oxo-,1-methylethyl ester) Related Products
- 154869-43-9(1,9-Dioxacyclohexadecane-2,5,10-trione,8,16-bis(2-oxopropyl)-, [8S-(8R*,16R*)]- (9CI))
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- 2854-10-6(tert-butyl 4-oxopentanoate)
- 57785-44-1(Oxacyclohexadecane-2,13-dione, 16-ethyl-)
- 89567-32-8(Oxacyclotridecane-2,9-dione, 13-methyl-)
- 154869-41-7(1,9-Dioxacyclohexadecane-2,5,10,13-tetrone,8,16-bis(2-oxopropyl)-, [8S-(8R*,16R*)]- (9CI))
- 156619-66-8(1,9-Dioxacyclohexadecane-2,5,10-trione,13-hydroxy-8,16-bis(2-oxopropyl)-)
- 872891-58-2(Butanedioic acid, methyl 4-oxocyclohexyl ester)
- 30658-25-4(2H-Pyran-2-one, tetrahydro-6-(4-oxopentyl)-)
- 89927-33-3(2(3H)-Furanone, dihydro-5-(3-oxobutyl)-)
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