Cas no 88444-20-6 (Pentanedioic acid, 3-(8-cyclohexyloctyl)-3-hydroxy-)
88444-20-6 structure
Product Name:Pentanedioic acid, 3-(8-cyclohexyloctyl)-3-hydroxy-
CAS No:88444-20-6
MF:C19H34O5
MW:342.470266819
CID:632536
PubChem ID:13785351
Update Time:2025-04-19
Pentanedioic acid, 3-(8-cyclohexyloctyl)-3-hydroxy- Chemical and Physical Properties
Names and Identifiers
-
- Pentanedioic acid, 3-(8-cyclohexyloctyl)-3-hydroxy-
- 3-(8-cyclohexyloctyl)-3-hydroxypentanedioic acid
- SCHEMBL10783292
- DTXSID20549426
- 88444-20-6
-
- Inchi： 1S/C19H34O5/c20-17(21)14-19(24,15-18(22)23)13-9-4-2-1-3-6-10-16-11-7-5-8-12-16/h16,24H,1-15H2,(H,20,21)(H,22,23)
- InChI Key： SVPTXEYGBZSOFQ-UHFFFAOYSA-N
- SMILES： OC(CC(=O)O)(CC(=O)O)CCCCCCCCC1CCCCC1
Computed Properties
- Exact Mass: 342.24062418g/mol
- Monoisotopic Mass: 342.24062418g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 3
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 24
- Rotatable Bond Count: 13
- Complexity: 358
- 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: 5.1
- Topological Polar Surface Area: 94.8?2
Pentanedioic acid, 3-(8-cyclohexyloctyl)-3-hydroxy- Related Literature
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Xiang Liu,Qian Sun,A. B. Djuri?i?,Maohai Xie,Baohu Dai,Jinyao Tang,Charles Surya,Changzhong Liao,Kaimin Shih RSC Adv., 2015,5, 100783-100789
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Xue-Ying Wang,Ying Pei,Min Xie,Zi-He Jin,Ya-Shi Xiao,Yang Wang,Li-Na Zhang,Yan Li,Wei-Hua Huang Lab Chip, 2015,15, 1178-1187
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Dhamodaran Manikandan,S. Amirthapandian,I. S. Zhidkov,A. I. Kukharenko,S. O. Cholakh,Ramaswamy Murugan Phys. Chem. Chem. Phys., 2018,20, 6500-6514
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P. K. Wawrzyniak,M. T. P. Beerepoot,H. J. M. de Groot,F. Buda Phys. Chem. Chem. Phys., 2011,13, 10270-10279
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Suji Lee,Min Su Han Chem. Commun., 2021,57, 9450-9453
88444-20-6 (Pentanedioic acid, 3-(8-cyclohexyloctyl)-3-hydroxy-) Related Products
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