Cas no 88662-75-3 (Carbonochloridic acid, 2,2-dimethylpentyl ester)
88662-75-3 structure
Product Name:Carbonochloridic acid, 2,2-dimethylpentyl ester
CAS No:88662-75-3
MF:C8H15ClO2
MW:178.656502008438
CID:625130
PubChem ID:71319423
Update Time:2025-04-19
Carbonochloridic acid, 2,2-dimethylpentyl ester Chemical and Physical Properties
Names and Identifiers
-
- Carbonochloridic acid, 2,2-dimethylpentyl ester
- 2,2-dimethylpentyl carbonochloridate
- 88662-75-3
- DTXSID00749447
-
- Inchi： 1S/C8H15ClO2/c1-4-5-8(2,3)6-11-7(9)10/h4-6H2,1-3H3
- InChI Key： KARXAJINMBPGEE-UHFFFAOYSA-N
- SMILES： ClC(=O)OCC(C)(C)CCC
Computed Properties
- Exact Mass: 178.0760574g/mol
- Monoisotopic Mass: 178.0760574g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 11
- Rotatable Bond Count: 5
- Complexity: 132
- 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
- XLogP3: 3.8
- Topological Polar Surface Area: 26.3?2
Carbonochloridic acid, 2,2-dimethylpentyl ester Related Literature
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Luke L. Lairson,Warren W. Wakarchuk Chem. Commun., 2007, 365-367
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Jing Chen,Yu Shao,Danzhen Li J. Mater. Chem. A, 2017,5, 937-941
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Huiying Xu,Lu Zheng,Yu Zhou,Bang-Ce Ye Analyst, 2021,146, 5542-5549
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Chandran Rajendran,Govindaswamy Satishkumar,Charlotte Lang,Eric M. Gaigneaux Catal. Sci. Technol., 2020,10, 2583-2592
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