Cas no 5420-45-1 (Dodecanoicacid, 2-butoxy-1-methyl-2-oxoethyl ester)
5420-45-1 structure
Product Name:Dodecanoicacid, 2-butoxy-1-methyl-2-oxoethyl ester
CAS No:5420-45-1
MF:C19H36O4
MW:328.486746788025
CID:387331
PubChem ID:222161
Update Time:2025-04-19
Dodecanoicacid, 2-butoxy-1-methyl-2-oxoethyl ester Chemical and Physical Properties
Names and Identifiers
-
- Dodecanoicacid, 2-butoxy-1-methyl-2-oxoethyl ester
- (1-butoxy-1-oxopropan-2-yl) dodecanoate
- 1-butoxy-1-oxopropan-2-yl dodecanoate
- 2-lauroyloxy-propionic acid butyl ester
- 2-Lauroyloxy-propionsaeure-butylester
- AC1L5BE5
- AC1Q5XH9
- AG-K-06698
- AR-1C2100
- CTK4J9976
- NSC7543
- O-Lauroyl-milchsaeure-butylester
- DTXSID10278470
- NSC-7543
- 5420-45-1
- dodecanoic acid 1-butoxycarbonyl-ethyl ester
-
- Inchi： 1S/C19H36O4/c1-4-6-8-9-10-11-12-13-14-15-18(20)23-17(3)19(21)22-16-7-5-2/h17H,4-16H2,1-3H3
- InChI Key： KPQUPLMSTJBRMC-UHFFFAOYSA-N
- SMILES： O(C(C)C(=O)OCCCC)C(CCCCCCCCCCC)=O
Computed Properties
- Exact Mass: 328.26148
- Monoisotopic Mass: 328.26135963g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 23
- Rotatable Bond Count: 17
- Complexity: 302
- 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: 6.8
- Topological Polar Surface Area: 52.6?2
Experimental Properties
- PSA: 52.6
- LogP: 5.18230
Dodecanoicacid, 2-butoxy-1-methyl-2-oxoethyl ester 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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Supaporn Sawadjoon,Joseph S. M. Samec Org. Biomol. Chem., 2011,9, 2548-2554
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Marta Liras,Isabel Quijada-Garrido,Marta Palacios-Cuesta,Sonia Mu?oz-Durieux,Olga García Polym. Chem., 2014,5, 433-442
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Inês S. Albuquerque,Hélia F. Jeremias,Miguel Chaves-Ferreira,Dijana Matak-Vinkovic,Omar Boutureira,Carlos C. Rom?o Chem. Commun., 2015,51, 3993-3996
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Kaiyuan Huang,Wangkang Qiu,Meilian Ou,Xiaorui Liu,Zenan Liao,Sheng Chu RSC Adv., 2020,10, 18824-18829
5420-45-1 (Dodecanoicacid, 2-butoxy-1-methyl-2-oxoethyl ester) Related Products
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