Cas no 75436-60-1 (Decanoic acid, 2-(2-oxopropyl)-, methyl ester)
75436-60-1 structure
Product Name:Decanoic acid, 2-(2-oxopropyl)-, methyl ester
CAS No:75436-60-1
MF:C14H26O3
MW:242.354444980621
CID:539534
PubChem ID:12593957
Update Time:2025-04-19
Decanoic acid, 2-(2-oxopropyl)-, methyl ester Chemical and Physical Properties
Names and Identifiers
-
- Decanoic acid, 2-(2-oxopropyl)-, methyl ester
- methyl 2-(2-oxopropyl)decanoate
- DTXSID60503709
- 75436-60-1
-
- Inchi： 1S/C14H26O3/c1-4-5-6-7-8-9-10-13(11-12(2)15)14(16)17-3/h13H,4-11H2,1-3H3
- InChI Key： CXSKYCGSFSHJPH-UHFFFAOYSA-N
- SMILES： O(C)C(C(CC(C)=O)CCCCCCCC)=O
Computed Properties
- Exact Mass: 242.18819469g/mol
- 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: 11
- Complexity: 224
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 3.9
- Topological Polar Surface Area: 43.4?2
Decanoic acid, 2-(2-oxopropyl)-, methyl ester Related Literature
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1. Excimer emission and magnetoluminescence of radical-based zinc(ii) complexes doped in host crystals?Shojiro Kimura,Tetsuro Kusamoto Chem. Commun., 2020,56, 11195-11198
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Norihito Fukui,Keisuke Fujimoto,Hideki Yorimitsu,Atsuhiro Osuka Dalton Trans., 2017,46, 13322-13341
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J. Zagora,M. Vosla?,L. Schreiberová,I. Schreiber Phys. Chem. Chem. Phys., 2002,4, 1284-1291
75436-60-1 (Decanoic acid, 2-(2-oxopropyl)-, methyl ester) Related Products
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- 39265-95-7(Methyl 3-acetyl-4-oxopentanoate)
- 1187-74-2(Acetonyl-succinic Acid Diethyl Ester)
- 695-95-4(Methyl 3-oxocyclobutane-1-carboxylate)
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