Cas no 80195-78-4 (Propanoic acid, 2,2-dimethyl-, 1-iodoethyl ester)
80195-78-4 structure
Product Name:Propanoic acid, 2,2-dimethyl-, 1-iodoethyl ester
CAS No:80195-78-4
MF:C7H13IO2
MW:256.081394910812
CID:706182
PubChem ID:13393064
Update Time:2025-04-19
Propanoic acid, 2,2-dimethyl-, 1-iodoethyl ester Chemical and Physical Properties
Names and Identifiers
-
- Propanoic acid, 2,2-dimethyl-, 1-iodoethyl ester
- 1-iodoethyl 2,2-dimethylpropanoate
- SCHEMBL2656297
- 1-iodoethyl pivalate
- 1-iodoethyl 2,2-dimethylpropionate
- 2,2-dimethyl-propionic acid 1-iodo-ethyl ester
- 1-pivaloyloxyethyl iodide
- NVEOVONPLNPXMB-UHFFFAOYSA-N
- DTXSID60539184
- 80195-78-4
-
- Inchi： 1S/C7H13IO2/c1-5(8)10-6(9)7(2,3)4/h5H,1-4H3
- InChI Key： NVEOVONPLNPXMB-UHFFFAOYSA-N
- SMILES： IC(C)OC(C(C)(C)C)=O
Computed Properties
- Exact Mass: 255.99603g/mol
- Monoisotopic Mass: 255.99603g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 10
- Rotatable Bond Count: 3
- Complexity: 126
- 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: 2.7
- Topological Polar Surface Area: 26.3?2
Propanoic acid, 2,2-dimethyl-, 1-iodoethyl ester Related Literature
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Huifang Yang,Haoran Guo,Peidong Fan,Xinpan Li,Wenlu Ren,Rui Song Nanoscale, 2020,12, 7024-7034
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M. Sheykhan,S. Khani,S. Shaabanzadeh,M. Joafshan Green Chem., 2017,19, 5940-5948
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Zhonghua Xiang,Chuanqi Fang,Sanhua Leng,Dapeng Cao J. Mater. Chem. A, 2014,2, 7662-7665
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Quan Xiang,Yiqin Chen,Zhiqin Li,Kaixi Bi,Guanhua Zhang,Huigao Duan Nanoscale, 2016,8, 19541-19550
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Huabin Zhang,Shaowu Du CrystEngComm, 2014,16, 4059-4068
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