Cas no 99418-52-7 (Ethanimidic acid, 2,2,2-trichloro-, 1-methylethyl ester)
99418-52-7 structure
Product Name:Ethanimidic acid, 2,2,2-trichloro-, 1-methylethyl ester
CAS No:99418-52-7
MF:C5H8Cl3NO
MW:204.482118606567
CID:1992139
PubChem ID:21469209
Update Time:2025-04-21
Ethanimidic acid, 2,2,2-trichloro-, 1-methylethyl ester Chemical and Physical Properties
Names and Identifiers
-
- Ethanimidic acid, 2,2,2-trichloro-, 1-methylethyl ester
- HLBBEEREPBXNDT-UHFFFAOYSA-N
- 2,2,2-trichloro-1-isopropoxyethanimine
- SCHEMBL2869141
- isopropyl trichloroacetimidate
- G87077
- isopropyl 2,2,2-trichloroacetimidate
- 99418-52-7
-
- Inchi： 1S/C5H8Cl3NO/c1-3(2)10-4(9)5(6,7)8/h3,9H,1-2H3
- InChI Key： HLBBEEREPBXNDT-UHFFFAOYSA-N
- SMILES： ClC(C(=N)OC(C)C)(Cl)Cl
Computed Properties
- Exact Mass: 202.967
- Monoisotopic Mass: 202.967
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 10
- Rotatable Bond Count: 2
- Complexity: 129
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 33.1A^2
- XLogP3: 2.9
Ethanimidic acid, 2,2,2-trichloro-, 1-methylethyl ester Related Literature
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Shintaro Takata,Yoshihiro Miura Phys. Chem. Chem. Phys., 2014,16, 24784-24789
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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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Joseph W. Bennett,Diamond T. Jones,Blake G. Hudson,Joshua Melendez-Rivera,Robert J. Hamers,Sara E. Mason Environ. Sci.: Nano, 2020,7, 1642-1651
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Zhixia Liu,Tingjian Chen,Floyd E. Romesberg Chem. Sci., 2017,8, 8179-8182
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Weili Dai,Guangjun Wu,Michael Hunger Chem. Commun., 2015,51, 13779-13782
99418-52-7 (Ethanimidic acid, 2,2,2-trichloro-, 1-methylethyl ester) Related Products
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