Cas no 37826-52-1 (Butanoic acid, 3-oxo-, decyl ester)
37826-52-1 structure
Product Name:Butanoic acid, 3-oxo-, decyl ester
CAS No:37826-52-1
MF:C14H26O3
MW:242.354444980621
CID:1486014
PubChem ID:432383
Update Time:2025-04-21
Butanoic acid, 3-oxo-, decyl ester Chemical and Physical Properties
Names and Identifiers
-
- Butanoic acid, 3-oxo-, decyl ester
- 3-oxobutyric acid decyl ester
- G68157
- SCHEMBL5972653
- decyl acetoacetate
- AKOS024390798
- 37826-52-1
- Decyl 3-oxobutanoate
-
- Inchi： 1S/C14H26O3/c1-3-4-5-6-7-8-9-10-11-17-14(16)12-13(2)15/h3-12H2,1-2H3
- InChI Key： CLCYRHCSVWOLHG-UHFFFAOYSA-N
- SMILES： O(C(CC(C)=O)=O)CCCCCCCCCC
Computed Properties
- Exact Mass: 242.18828
- Monoisotopic Mass: 242.18819469g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 17
- Rotatable Bond Count: 12
- Complexity: 212
- 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: 4.3
- Topological Polar Surface Area: 43.4?2
Experimental Properties
- PSA: 43.37
Butanoic acid, 3-oxo-, decyl ester Related Literature
-
Vishwesh Venkatraman,Marco Foscato,Vidar R. Jensen,Bj?rn K?re Alsberg J. Mater. Chem. A, 2015,3, 9851-9860
-
Hongxia Li,Aikifa Raza,Qiaoyu Ge,Jin-You Lu,TieJun Zhang Soft Matter, 2020,16, 6841-6849
-
Xinhuan Wang,Shuangfei Cai,Cui Qi Analyst, 2017,142, 2500-2506
-
Ivor Lon?ari? Phys. Chem. Chem. Phys., 2015,17, 9436-9445
-
Thi Thu Tram Nguyen,Thanh Binh Nguyen Org. Biomol. Chem., 2021,19, 6015-6020
37826-52-1 (Butanoic acid, 3-oxo-, decyl ester) Related Products
- 2052-15-5(Butyl 4-oxopentanoate)
- 4949-44-4(Ethyl 3-oxopentanoate)
- 7152-15-0(Ethyl isobutyrylacetate)
- 22502-03-0(2-Methoxyethyl acetoacetate)
- 539-88-8(Ethyl levulinate)
- 100548-44-5(Butanoic-4-13C acid,3-oxo-, ethyl ester (9CI))
- 105-50-0(Diethyl 3-oxopentanedioate)
- 3249-68-1(Ethyl butyrylacetate)
- 30414-53-0(Methyl 3-oxopentanoate)
- 1830-54-2(Dimethyl acetone-1,3-dicarboxylate)
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