Cas no 58650-45-6 (Cyclopropanecarboxylicacid, 2-pentyl-, (1R,2S)-rel-)
58650-45-6 structure
Product Name:Cyclopropanecarboxylicacid, 2-pentyl-, (1R,2S)-rel-
CAS No:58650-45-6
MF:C9H16O2
MW:156.222143173218
CID:372091
PubChem ID:21116976
Update Time:2025-04-19
Cyclopropanecarboxylicacid, 2-pentyl-, (1R,2S)-rel- Chemical and Physical Properties
Names and Identifiers
-
- Cyclopropanecarboxylicacid, 2-pentyl-, (1R,2S)-rel-
- cis-2-pentylcyclopropanecarboxylic acid
- Cyclopropanecarboxylic acid, 2-pentyl-, cis-
- SCHEMBL3493155
- DTXSID00886280
- 58650-45-6
- Cyclopropanecarboxylic acid, 2-pentyl-, (1R,2S)-rel-
-
- Inchi: 1S/C9H16O2/c1-2-3-4-5-7-6-8(7)9(10)11/h7-8H,2-6H2,1H3,(H,10,11)/t7-,8+/m0/s1
- InChI Key: ZWABCHPDBORTSF-JGVFFNPUSA-N
- SMILES: OC([C@@H]1C[C@@H]1CCCCC)=O
Computed Properties
- Exact Mass: 156.11508
- Monoisotopic Mass: 156.115029749g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 11
- Rotatable Bond Count: 5
- Complexity: 143
- 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: 2.8
- Topological Polar Surface Area: 37.3?2
Experimental Properties
- PSA: 37.3
Cyclopropanecarboxylicacid, 2-pentyl-, (1R,2S)-rel- Related Literature
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Xiaotong Feng,Lei Bian,Jie Ma,Lei Zhou,Xiayan Wang,Guangsheng Guo,Qiaosheng Pu Chem. Commun., 2019,55, 3963-3966
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Denis V. Korchagin,Elena A. Yureva,Alexander V. Akimov,Eugenii Ya. Misochko,Gennady V. Shilov,Artem D. Talantsev,Roman B. Morgunov,Alexander A. Shakin,Sergey M. Aldoshin,Boris S. Tsukerblat Dalton Trans., 2017,46, 7540-7548
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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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Yong Ping Huang,Tao Tao,Zheng Chen,Wei Han,Ying Wu,Chunjiang Kuang,Shaoxiong Zhou,Ying Chen J. Mater. Chem. A, 2014,2, 18831-18837
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Abdelaziz Houmam,Emad M. Hamed Chem. Commun., 2012,48, 11328-11330
Related Categories
- Solvents and Organic Chemicals Organic Compounds Organic acids and derivatives Carboxylic acids and derivatives Cyclopropanecarboxylic acids
- Solvents and Organic Chemicals Organic Compounds Organic acids and derivatives Carboxylic acids and derivatives Cyclopropanecarboxylic acids and derivatives Cyclopropanecarboxylic acids
58650-45-6 (Cyclopropanecarboxylicacid, 2-pentyl-, (1R,2S)-rel-) Related Products
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