Cas no 61478-20-4 (2-Butanol, 4-(1,1-dimethylethoxy)-3,3-dimethyl-)
61478-20-4 structure
Product Name:2-Butanol, 4-(1,1-dimethylethoxy)-3,3-dimethyl-
CAS No:61478-20-4
MF:C10H22O2
MW:174.280483722687
CID:477919
PubChem ID:71395477
Update Time:2025-04-19
2-Butanol, 4-(1,1-dimethylethoxy)-3,3-dimethyl- Chemical and Physical Properties
Names and Identifiers
-
- 2-Butanol, 4-(1,1-dimethylethoxy)-3,3-dimethyl-
- 3,3-dimethyl-4-[(2-methylpropan-2-yl)oxy]butan-2-ol
- 4-tert-Butoxy-3,3-dimethylbutan-2-ol
- 61478-20-4
- DTXSID20817091
-
- Inchi： 1S/C10H22O2/c1-8(11)10(5,6)7-12-9(2,3)4/h8,11H,7H2,1-6H3
- InChI Key： SXXZANKYPHGQLT-UHFFFAOYSA-N
- SMILES： O(C(C)(C)C)CC(C)(C)C(C)O
Computed Properties
- Exact Mass: 174.16206
- Monoisotopic Mass: 174.161979940g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 12
- Rotatable Bond Count: 4
- Complexity: 133
- 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
- Topological Polar Surface Area: 29.5?2
Experimental Properties
- PSA: 29.46
2-Butanol, 4-(1,1-dimethylethoxy)-3,3-dimethyl- Related Literature
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Xiang Liu,Qian Sun,A. B. Djuri?i?,Maohai Xie,Baohu Dai,Jinyao Tang,Charles Surya,Changzhong Liao,Kaimin Shih RSC Adv., 2015,5, 100783-100789
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2. An all-solid-state imprinted polymer-based potentiometric sensor for determination of bisphenol S?Rongning Liang,Tanji Yin,Ruiqing Yao,Wei Qin RSC Adv., 2016,6, 73308-73312
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S. Amaresh,K. Karthikeyan,K. J. Kim,Y. S. Lee RSC Adv., 2014,4, 23107-23115
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Suji Lee,Min Su Han Chem. Commun., 2021,57, 9450-9453
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Philipp Traber,Stephan Kupfer,Stefanie Gr?fe,Isabelle Baussanne,Martine Demeunynck,Jean-Marie Mouesca,Serge Gambarelli,Vincent Artero,Murielle Chavarot-Kerlidou Chem. Sci., 2018,9, 4152-4159
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