Cas no 25234-24-6 (Propanedioic acid, 2-ethyl-2-hexyl-, 1,3-diethyl ester)
25234-24-6 structure
Product Name:Propanedioic acid, 2-ethyl-2-hexyl-, 1,3-diethyl ester
CAS No:25234-24-6
MF:C15H28O4
MW:272.380425453186
CID:291347
PubChem ID:240549
Update Time:2025-04-19
Propanedioic acid, 2-ethyl-2-hexyl-, 1,3-diethyl ester Chemical and Physical Properties
Names and Identifiers
-
- Propanedioic acid, 2-ethyl-2-hexyl-, 1,3-diethyl ester
- diethyl 2-ethyl-2-hexylpropanedioate
- AC1L65FR
- AC1Q63RO
- Aethyl-hexyl-malonsaeure-diaethylester
- AG-J-68736
- AR-1I4684
- CTK1A8011
- diethyl ethyl(hexyl)propanedioate
- ethyl-hexyl-malonic acid diethyl ester
- Ethyl-hexyl-malonsaeure-diethylester
- NSC46891
- 25234-24-6
- DTXSID70286657
- DIETHYL ETHYLHEXYL MALONATE
- diethyl 2-ethyl-2-hexylmalonate
- NSC-46891
- BENZENEPROPANOICACID,A-HYDROXY-4-METHOXY-
- 24306-19-2
- SCHEMBL5860622
-
- Inchi： 1S/C15H28O4/c1-5-9-10-11-12-15(6-2,13(16)18-7-3)14(17)19-8-4/h5-12H2,1-4H3
- InChI Key： NESROWJMOIQZIL-UHFFFAOYSA-N
- SMILES： O(CC)C(C(C(=O)OCC)(CC)CCCCCC)=O
Computed Properties
- Exact Mass: 272.19884
- Monoisotopic Mass: 272.19875937g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 19
- Rotatable Bond Count: 12
- Complexity: 255
- 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: 4.7
- Topological Polar Surface Area: 52.6?2
Experimental Properties
- PSA: 52.6
Propanedioic acid, 2-ethyl-2-hexyl-, 1,3-diethyl ester Related Literature
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Shaun D. Wong,Edward I. Solomon Dalton Trans., 2014,43, 17567-17577
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Domenico Lombardo,Gianmarco Munaò,Pietro Calandra,Luigi Pasqua,Maria Teresa Caccamo Phys. Chem. Chem. Phys., 2019,21, 11983-11991
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Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
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Xingqun Zheng,Lele Song,Xin Feng,Li Li,Zidong Wei J. Mater. Chem. A, 2020,8, 14145-14151
-
Zhixia Liu,Tingjian Chen,Floyd E. Romesberg Chem. Sci., 2017,8, 8179-8182
25234-24-6 (Propanedioic acid, 2-ethyl-2-hexyl-, 1,3-diethyl ester) Related Products
- 27132-23-6(Dimethyl diethylmalonate)
- 3779-29-1(1,1-diethyl cyclobutane-1,1-dicarboxylate)
- 14035-96-2(Dimethyl 2-propylmalonate)
- 7459-46-3(1,1,2-triethyl ethane-1,1,2-tricarboxylate)
- 133-13-1(1,3-diethyl 2-ethylpropanedioate)
- 596-75-8(Diethyl dibutylmalonate)
- 1559-02-0(Diethyl 1,1-cyclopropanedicarboxylate)
- 2163-48-6(Diethyl propylmalonate)
- 10203-58-4(Diethyl isobutylmalonate)
- 759-36-4(Diethyl isopropylmalonate)
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