Cas no 119105-74-7 (11-chlorododecanoic acid)
11-chlorododecanoic acid structure
Product Name:11-chlorododecanoic acid
CAS No:119105-74-7
MF:C12H23ClO2
MW:234.762823343277
CID:2616181
PubChem ID:71339587
Update Time:2025-04-21
11-chlorododecanoic acid Chemical and Physical Properties
Names and Identifiers
-
- 11-chlorododecanoic acid
- 119105-74-7
- DTXSID90766986
-
- Inchi： 1S/C12H23ClO2/c1-11(13)9-7-5-3-2-4-6-8-10-12(14)15/h11H,2-10H2,1H3,(H,14,15)
- InChI Key： WSJSRTKETCZHHK-UHFFFAOYSA-N
- SMILES： ClC(C)CCCCCCCCCC(=O)O
Computed Properties
- Exact Mass: 234.1386577Da
- Monoisotopic Mass: 234.1386577Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 15
- Rotatable Bond Count: 10
- Complexity: 160
- 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: 4.5
- Topological Polar Surface Area: 37.3?2
11-chlorododecanoic acid Related Literature
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Adeline Huiling Loo,Alessandra Bonanni,Martin Pumera Analyst, 2013,138, 467-471
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Yu-Nong Li,Liang-Nian He,Xian-Dong Lang,Xiao-Fang Liu,Shuai Zhang RSC Adv., 2014,4, 49995-50002
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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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Juan J. Sánchez,Miguel López-Haro,Juan C. Hernández-Garrido,Ginesa Blanco,Miguel A. Cauqui,José M. Rodríguez-Izquierdo,José A. Pérez-Omil,José J. Calvino,María P. Yeste J. Mater. Chem. A, 2019,7, 8993-9003
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