Cas no 3242-53-3 (Undecanedioic acid,6-oxo-)
Undecanedioic acid,6-oxo- structure
Product Name:Undecanedioic acid,6-oxo-
CAS No:3242-53-3
MF:C11H18O5
MW:230.257624149323
CID:295155
PubChem ID:10633211
Update Time:2025-04-19
Undecanedioic acid,6-oxo- Chemical and Physical Properties
Names and Identifiers
-
- Undecanedioic acid,6-oxo-
- 6-Oxoundecanedioicacid
- 6-oxoundecanedioic acid
- 6-Oxo-undecanedioic acid
- DTXSID10442795
- 3242-53-3
- 6-Ketohendecanedioic acid
- SCHEMBL7834412
- 6-keto-hendecanedioic acid
-
- Inchi: 1S/C11H18O5/c12-9(5-1-3-7-10(13)14)6-2-4-8-11(15)16/h1-8H2,(H,13,14)(H,15,16)
- InChI Key: YZHMDWJIJMFCHQ-UHFFFAOYSA-N
- SMILES: O=C(CCCCC(=O)O)CCCCC(=O)O
Computed Properties
- Exact Mass: 230.11544
- Monoisotopic Mass: 230.11542367g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 16
- Rotatable Bond Count: 10
- Complexity: 223
- 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: 0.4
- Topological Polar Surface Area: 91.7?2
Experimental Properties
- PSA: 91.67
Undecanedioic acid,6-oxo- Related Literature
-
Li-Hua Gan,Rui Wu,Jian-Lei Tian,Patrick W. Fowler Phys. Chem. Chem. Phys., 2017,19, 419-425
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M. T. Colomer,S. Díaz-Moreno,A. Tamayo,A. L. Ortiz J. Mater. Chem. C, 2018,6, 12643-12651
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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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Bo Cao,Yin Wei Chem. Commun., 2018,54, 2870-2873
-
Kanjun Sun,Fengting Hua,Shuzhen Cui,Yanrong Zhu,Hui Peng,Guofu Ma RSC Adv., 2021,11, 37631-37642
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