Cas no 20602-31-7 (dipentyl propanedioate)
dipentyl propanedioate structure
Product Name:dipentyl propanedioate
CAS No:20602-31-7
MF:C13H24O4
MW:244.327264785767
CID:1398876
PubChem ID:524369
Update Time:2025-04-20
dipentyl propanedioate Chemical and Physical Properties
Names and Identifiers
-
- dipentyl propanedioate
- Dipentyl malonate
- propanedioic acid, dipentyl ester
- MOJJCFBDUWMVJK-UHFFFAOYSA-N
- 20602-31-7
- Diamylmalonat
- AKOS024390673
- DTXSID70335295
- propanedioic acid dipentyl ester
- SCHEMBL240774
-
- Inchi： 1S/C13H24O4/c1-3-5-7-9-16-12(14)11-13(15)17-10-8-6-4-2/h3-11H2,1-2H3
- InChI Key： MOJJCFBDUWMVJK-UHFFFAOYSA-N
- SMILES： O(C(CC(=O)OCCCCC)=O)CCCCC
Computed Properties
- Exact Mass: 244.16752
- Monoisotopic Mass: 244.16745924g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 17
- Rotatable Bond Count: 12
- Complexity: 192
- 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: 3.7
- Topological Polar Surface Area: 52.6?2
Experimental Properties
- PSA: 52.6
dipentyl propanedioate Related Literature
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Mark D. Allendorf,Alauddin Ahmed,Tom Autrey,Jeffrey Camp,Eun Seon Cho,Maciej Haranczyk,Abhi Karkamkar,Di-Jia Liu,Katie R. Meihaus,Iffat H. Nayyar,Roman Nazarov,Donald J. Siegel,Vitalie Stavila,Jeffrey J. Urban,Srimukh Prasad Veccham,Brandon C. Wood Energy Environ. Sci., 2018,11, 2784-2812
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Chongyang Zhu,Xiaojia Bian,Xin Jia,Ning Tang,Yongqiang Cheng Food Funct., 2020,11, 10635-10644
-
Kanjun Sun,Fengting Hua,Shuzhen Cui,Yanrong Zhu,Hui Peng,Guofu Ma RSC Adv., 2021,11, 37631-37642
-
Supaporn Sawadjoon,Joseph S. M. Samec Org. Biomol. Chem., 2011,9, 2548-2554
20602-31-7 (dipentyl propanedioate) Related Products
- 1190-39-2(Dibutyl malonate)
- 16958-88-6(Propanedioic acid,1,3-dioctyl ester)
- 207444-67-5(Propanedioic acid,1,3-bis(3-carboxypropyl) ester)
- 17373-84-1(Butyl ethyl malonate)
- 332062-08-5(Fmoc-S-3-amino-4,4-diphenyl-butyric acid)
- 1270529-38-8(1,2,3,4,5,6-Hexahydro-[2,3]bipyridinyl-6-ol)
- 2680771-01-9(4-cyclopentyl-3-{(prop-2-en-1-yloxy)carbonylamino}butanoic acid)
- 2098070-20-1(2-(3-(Pyridin-3-yl)-1H-pyrazol-1-yl)acetimidamide)
- 1444113-98-7(N-(3-cyanothiolan-3-yl)-2-[(2,2,2-trifluoroethyl)sulfanyl]pyridine-4-carboxamide)
- 941977-17-9(N'-(3-chloro-2-methylphenyl)-N-2-(dimethylamino)-2-(naphthalen-1-yl)ethylethanediamide)
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