Cas no 62173-56-2 (Cyclohexaneacetic acid, α-chloro-, methyl ester)
62173-56-2 structure
Product Name:Cyclohexaneacetic acid, α-chloro-, methyl ester
CAS No:62173-56-2
MF:C9H15ClO2
MW:190.667202234268
CID:455555
PubChem ID:62224732
Update Time:2024-03-01
Cyclohexaneacetic acid, α-chloro-, methyl ester Chemical and Physical Properties
Names and Identifiers
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- Cyclohexaneacetic acid, a-chloro-, methyl ester
- Cyclohexaneacetic acid, α-chloro-, methyl ester
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- Inchi： 1S/C9H15ClO2/c1-12-9(11)8(10)7-5-3-2-4-6-7/h7-8H,2-6H2,1H3
- InChI Key： ZXBBZKVOOJGKGB-UHFFFAOYSA-N
- SMILES： ClC(C(=O)OC)C1CCCCC1
Computed Properties
- Exact Mass: 190.0760574g/mol
- Monoisotopic Mass: 190.0760574g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 12
- Rotatable Bond Count: 3
- Complexity: 153
- 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: 3.1
- Topological Polar Surface Area: 26.3?2
Cyclohexaneacetic acid, α-chloro-, methyl ester Related Literature
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Christopher B. Rodell,Christopher B. Highley,Minna H. Chen,Neville N. Dusaj,Chao Wang,Lin Han,Jason A. Burdick Soft Matter, 2016,12, 7839-7847
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Hongxia Li,Aikifa Raza,Qiaoyu Ge,Jin-You Lu,TieJun Zhang Soft Matter, 2020,16, 6841-6849
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Gang Pan,Yi-jie Bao,Jie Xu,Tao Liu,Cheng Liu,Yan-yan Qiu,Xiao-jing Shi,Hui Yu,Ting-ting Jia,Xia Yuan,Ze-ting Yuan,Yi-jun Cao RSC Adv., 2016,6, 42109-42119
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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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Partha Laskar,Christine Dufès Nanoscale Adv., 2021,3, 6007-6026
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