Cas no 88333-10-2 (Cyclopropanecarboxylic acid, 2-ethoxy-, methyl ester, trans-)
88333-10-2 structure
Product Name:Cyclopropanecarboxylic acid, 2-ethoxy-, methyl ester, trans-
CAS No:88333-10-2
MF:C7H12O3
MW:144.168382644653
CID:636800
PubChem ID:71409034
Update Time:2025-04-19
Cyclopropanecarboxylic acid, 2-ethoxy-, methyl ester, trans- Chemical and Physical Properties
Names and Identifiers
-
- Cyclopropanecarboxylic acid, 2-ethoxy-, methyl ester, trans-
- methyl (1R,2R)-2-ethoxycyclopropane-1-carboxylate
- 88333-10-2
- DTXSID40828806
-
- Inchi： 1S/C7H12O3/c1-3-10-6-4-5(6)7(8)9-2/h5-6H,3-4H2,1-2H3/t5-,6-/m1/s1
- InChI Key： HZSHLYGWMXZBCE-PHDIDXHHSA-N
- SMILES： O(CC)[C@@H]1C[C@H]1C(=O)OC
Computed Properties
- Exact Mass: 144.078644241g/mol
- Monoisotopic Mass: 144.078644241g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 10
- Rotatable Bond Count: 4
- Complexity: 133
- 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: 0.5
- Topological Polar Surface Area: 35.5?2
Cyclopropanecarboxylic acid, 2-ethoxy-, methyl ester, trans- Related Literature
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Xiaoming Liu,Zachary D. Hood,Wangda Li,Donovan N. Leonard,Arumugam Manthiram,Miaofang Chi J. Mater. Chem. A, 2021,9, 2111-2119
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Erika A. Cobar,Paul R. Horn,Robert G. Bergman,Martin Head-Gordon Phys. Chem. Chem. Phys., 2012,14, 15328-15339
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Chao-Han Cheng,Wen-Zhen Wang,Shie-Ming Peng,I-Chia Chen Phys. Chem. Chem. Phys., 2017,19, 25471-25477
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Tao Wang,Yangyang Liu,Yue Deng,Hongbo Fu,Jianmin Chen Environ. Sci.: Nano, 2018,5, 1821-1833
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Shun-Ze Zhan,Mian Li,Xiao-Ping Zhou,Dan Li,Seik Weng Ng RSC Adv., 2011,1, 1457-1459
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