Cas no 106689-05-8 (Methyl 16-iodohexadecanoate)
Methyl 16-iodohexadecanoate structure
Product Name:Methyl 16-iodohexadecanoate
CAS No:106689-05-8
MF:C17H33IO2
MW:396.34719824791
CID:1176168
PubChem ID:10453336
Update Time:2025-04-20
Methyl 16-iodohexadecanoate Chemical and Physical Properties
Names and Identifiers
-
- Methyl 16-iodohexadecanoate
- SCHEMBL9244508
- DTXSID60440201
- Hexadecanoic acid, 16-iodo-, methyl ester
- 106689-05-8
-
- Inchi： 1S/C17H33IO2/c1-20-17(19)15-13-11-9-7-5-3-2-4-6-8-10-12-14-16-18/h2-16H2,1H3
- InChI Key： FOHXUGJFBSGTCP-UHFFFAOYSA-N
- SMILES： ICCCCCCCCCCCCCCCC(=O)OC
Computed Properties
- Exact Mass: 396.15253g/mol
- Monoisotopic Mass: 396.15253g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 20
- Rotatable Bond Count: 16
- Complexity: 207
- 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: 8.7
- Topological Polar Surface Area: 26.3?2
Methyl 16-iodohexadecanoate Related Literature
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Hongxia Li,Aikifa Raza,Qiaoyu Ge,Jin-You Lu,TieJun Zhang Soft Matter, 2020,16, 6841-6849
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Fereshteh Bayat Environ. Sci.: Nano, 2021,8, 367-389
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M. Zeiger,N. J?ckel,P. Strubel,L. Borchardt,R. Reinhold,W. Nickel,J. Eckert,V. Presser,S. Kaskel J. Mater. Chem. A, 2015,3, 17983-17990
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Alexandre Vimont,Arnaud Travert,Philippe Bazin,Jean-Claude Lavalley,Marco Daturi,Christian Serre,Gérard Férey,Sandrine Bourrelly,Philip L. Llewellyn Chem. Commun., 2007, 3291-3293
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J. Matthew Kurley,Phillip W. Halstenberg,Abbey McAlister,Stephen Raiman,Richard T. Mayes RSC Adv., 2019,9, 25602-25608
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