Cas no 96188-52-2 (Cyclohexanecarbonylchloride, 2-(1,1-dimethylethyl)-)
96188-52-2 structure
Product Name:Cyclohexanecarbonylchloride, 2-(1,1-dimethylethyl)-
CAS No:96188-52-2
MF:C11H19ClO
MW:202.720962762833
CID:800119
PubChem ID:20245952
Update Time:2025-04-19
Cyclohexanecarbonylchloride, 2-(1,1-dimethylethyl)- Chemical and Physical Properties
Names and Identifiers
-
- Cyclohexanecarbonylchloride, 2-(1,1-dimethylethyl)-
- 2-tert-butylcyclohexane-1-carbonyl chloride
- Cyclohexanecarbonyl chloride, 2-(1,1-dimethylethyl)- (9CI)
- SCHEMBL10605160
- 96188-52-2
- DTXSID90604056
-
- Inchi： 1S/C11H19ClO/c1-11(2,3)9-7-5-4-6-8(9)10(12)13/h8-9H,4-7H2,1-3H3
- InChI Key： BLEFFJIHHNLKDC-UHFFFAOYSA-N
- SMILES： ClC(C1CCCCC1C(C)(C)C)=O
Computed Properties
- Exact Mass: 202.1124429g/mol
- Monoisotopic Mass: 202.1124429g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 13
- Rotatable Bond Count: 2
- Complexity: 193
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 2
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 4.5
- Topological Polar Surface Area: 17.1?2
Cyclohexanecarbonylchloride, 2-(1,1-dimethylethyl)- Related Literature
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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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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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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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Danlei Xiang Nanoscale, 2021,13, 5497-5506
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