Cas no 65817-42-7 ((2S,5S)-2,5-Dimethylcyclopentane-1,1-dicarboxylic acid)
65817-42-7 structure
Product Name:(2S,5S)-2,5-Dimethylcyclopentane-1,1-dicarboxylic acid
CAS No:65817-42-7
MF:C9H14O4
MW:186.205063343048
CID:2844126
PubChem ID:71370145
Update Time:2025-04-21
(2S,5S)-2,5-Dimethylcyclopentane-1,1-dicarboxylic acid Chemical and Physical Properties
Names and Identifiers
-
- (2S,5S)-2,5-Dimethylcyclopentane-1,1-dicarboxylic acid
- 65817-42-7
- DTXSID70793139
-
- Inchi： 1S/C9H14O4/c1-5-3-4-6(2)9(5,7(10)11)8(12)13/h5-6H,3-4H2,1-2H3,(H,10,11)(H,12,13)/t5-,6-/m0/s1
- InChI Key： BEGZZVINPDCXMZ-WDSKDSINSA-N
- SMILES： OC(C1(C(=O)O)[C@@H](C)CC[C@@H]1C)=O
Computed Properties
- Exact Mass: 186.08920892Da
- Monoisotopic Mass: 186.08920892Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 13
- Rotatable Bond Count: 2
- Complexity: 220
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 2
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 1.8
- Topological Polar Surface Area: 74.6?2
(2S,5S)-2,5-Dimethylcyclopentane-1,1-dicarboxylic acid Related Literature
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Alvin Tanudjaja,Shinsuke Inagi,Fusao Kitamura,Toshikazu Takata,Ikuyoshi Tomita Dalton Trans., 2021,50, 3037-3043
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Suji Lee,Min Su Han Chem. Commun., 2021,57, 9450-9453
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Muniyandi Sankaralingam,So Hyun Jeon,Yong-Min Lee,Mi Sook Seo,Wonwoo Nam Dalton Trans., 2016,45, 376-383
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Huiying Xu,Lu Zheng,Yu Zhou,Bang-Ce Ye Analyst, 2021,146, 5542-5549
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Hyejin Moon,Aaron R. Wheeler,Robin L. Garrell,Chang-Jin “CJ” Kim Lab Chip, 2006,6, 1213-1219
65817-42-7 ((2S,5S)-2,5-Dimethylcyclopentane-1,1-dicarboxylic acid) Related Products
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