Cas no 62813-69-8 (Decane, 4-methoxy-4-methyl-)
Decane, 4-methoxy-4-methyl- structure
Product Name:Decane, 4-methoxy-4-methyl-
CAS No:62813-69-8
MF:C12H26O
MW:186.334244251251
CID:430579
PubChem ID:71382514
Update Time:2025-04-19
Decane, 4-methoxy-4-methyl- Chemical and Physical Properties
Names and Identifiers
-
- Decane, 4-methoxy-4-methyl-
- 4-methoxy-4-methyldecane
- 62813-69-8
- DTXSID30804891
-
- Inchi： 1S/C12H26O/c1-5-7-8-9-11-12(3,13-4)10-6-2/h5-11H2,1-4H3
- InChI Key： AGNCQLIBSNBMJW-UHFFFAOYSA-N
- SMILES： O(C)C(C)(CCC)CCCCCC
Computed Properties
- Exact Mass: 186.19848
- Monoisotopic Mass: 186.198365449g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 13
- Rotatable Bond Count: 8
- Complexity: 112
- 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: 4.5
- Topological Polar Surface Area: 9.2?2
Experimental Properties
- PSA: 9.23
Decane, 4-methoxy-4-methyl- Related Literature
-
Cheng Fang,Jinjian Wu,Zahra Sobhani,Md. Al Amin,Youhong Tang Anal. Methods, 2019,11, 163-170
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Priyambada Nayak,Tanmaya Badapanda,Anil Kumar Singh,Simanchalo Panigrahi RSC Adv., 2017,7, 16319-16331
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Haitao Li,Yu Pan,Zhizhi Wang,Shan Chen,Ruixin Guo,Jianqiu Chen RSC Adv., 2015,5, 100775-100782
-
M. T. Colomer,S. Díaz-Moreno,A. Tamayo,A. L. Ortiz J. Mater. Chem. C, 2018,6, 12643-12651
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