Cas no 14206-05-4 (Propaneperoxoicacid, 1,1-dimethylethyl ester)
14206-05-4 structure
Product Name:Propaneperoxoicacid, 1,1-dimethylethyl ester
CAS No:14206-05-4
MF:C7H14O3
MW:146.184262752533
CID:234290
PubChem ID:312710
Update Time:2025-04-19
Propaneperoxoicacid, 1,1-dimethylethyl ester Chemical and Physical Properties
Names and Identifiers
-
- Propaneperoxoicacid, 1,1-dimethylethyl ester
- tert-butyl propaneperoxoate
- AC1L7LWF
- Ethylcarbonyl-tert-butylperoxid
- NSC223071
- Perpropionsaeure-tert.-butylester
- Propionsaeure-t-butylperester
- Propionyl-tert.-butylperoxyester
- tert.-Butyl-perpropionat
- tert-butyl peroxypropionate
- Propaneperoxoic acid, 1,1-dimethylethyl ester
- NS00131817
- Propaneperoxoicacid,1,1-dimethylethyl ester
- SCHEMBL8529866
- 14206-05-4
- NSC-223071
- DTXSID10310248
-
- Inchi： 1S/C7H14O3/c1-5-6(8)9-10-7(2,3)4/h5H2,1-4H3
- InChI Key： BBXFLQCFPROIMX-UHFFFAOYSA-N
- SMILES： O(C(C)(C)C)OC(CC)=O
Computed Properties
- Exact Mass: 146.09432
- Monoisotopic Mass: 146.094294304g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 10
- Rotatable Bond Count: 4
- Complexity: 113
- 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: 1.6
- Topological Polar Surface Area: 35.5?2
Experimental Properties
- PSA: 35.53
Propaneperoxoicacid, 1,1-dimethylethyl ester Related Literature
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Xixi Li,Nanwei Zhu,Ruohan Li,Qinpu Zhang Anal. Methods, 2020,12, 3376-3381
-
Hamid Heydari,Mohammad B. Gholivand New J. Chem., 2017,41, 237-244
-
Jieun Kim,Han-Saem Park,Tae-Hee Kim,Sung Yeol Kim,Hyun-Kon Song Phys. Chem. Chem. Phys., 2014,16, 5295-5300
-
Yang Chen,Di Zhou,Zheyi Meng,Jin Zhai Chem. Commun., 2016,52, 10020-10023
-
Zhonghua Xiang,Chuanqi Fang,Sanhua Leng,Dapeng Cao J. Mater. Chem. A, 2014,2, 7662-7665
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