Cas no 90041-09-1 (Cyclopropanecarboxylic acid, 2,2-dichloro-, ethyl ester)
90041-09-1 structure
Product Name:Cyclopropanecarboxylic acid, 2,2-dichloro-, ethyl ester
CAS No:90041-09-1
MF:C6H8Cl2O2
MW:183.032520294189
CID:795692
PubChem ID:15652392
Update Time:2025-04-19
Cyclopropanecarboxylic acid, 2,2-dichloro-, ethyl ester Chemical and Physical Properties
Names and Identifiers
-
- Cyclopropanecarboxylic acid, 2,2-dichloro-, ethyl ester
- ethyl 2,2-dichlorocyclopropane-1-carboxylate
- DTXSID80576354
- 90041-09-1
- SCHEMBL3691417
-
- Inchi： 1S/C6H8Cl2O2/c1-2-10-5(9)4-3-6(4,7)8/h4H,2-3H2,1H3
- InChI Key： BNSVECUNFVIJDD-UHFFFAOYSA-N
- SMILES： ClC1(CC1C(=O)OCC)Cl
Computed Properties
- Exact Mass: 181.9901349g/mol
- Monoisotopic Mass: 181.9901349g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 10
- Rotatable Bond Count: 3
- Complexity: 156
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 1.7
- Topological Polar Surface Area: 26.3?2
Cyclopropanecarboxylic acid, 2,2-dichloro-, ethyl ester Related Literature
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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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Chao-Han Cheng,Wen-Zhen Wang,Shie-Ming Peng,I-Chia Chen Phys. Chem. Chem. Phys., 2017,19, 25471-25477
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Maomao Hou,Fenglin Zhong,Qiu Jin,Enjiang Liu,Jie Feng,Tengyun Wang,Yue Gao RSC Adv., 2017,7, 34392-34400
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Jason Y. C. Lim,Yong Yu,Guorui Jin,Kai Li,Yi Lu,Jianping Xie Nanoscale Adv., 2020,2, 3921-3932
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Partha Laskar,Christine Dufès Nanoscale Adv., 2021,3, 6007-6026
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