Cas no 64041-99-2 (Acetic acid, [(1,1-dimethylpropyl)thio]-)
![Acetic acid, [(1,1-dimethylpropyl)thio]- structure](https://ossimg.kuujia.com/scimg/64500/64041-99-2x500.png)
64041-99-2 structure
Product Name:Acetic acid, [(1,1-dimethylpropyl)thio]-
CAS No:64041-99-2
MF:C7H14O2S
MW:162.249861240387
CID:1666597
PubChem ID:71380537
Update Time:2025-04-21
Acetic acid, [(1,1-dimethylpropyl)thio]- Chemical and Physical Properties
Names and Identifiers
-
- Acetic acid, [(1,1-dimethylpropyl)thio]-
- 2-(2-methylbutan-2-ylsulfanyl)acetic acid
- [(2-Methylbutan-2-yl)sulfanyl]acetic acid
- DTXSID90803047
- 64041-99-2
-
- Inchi： 1S/C7H14O2S/c1-4-7(2,3)10-5-6(8)9/h4-5H2,1-3H3,(H,8,9)
- InChI Key： SYNJFBQSBGNXKD-UHFFFAOYSA-N
- SMILES： S(CC(=O)O)C(C)(C)CC
Computed Properties
- Exact Mass: 162.07152
- Monoisotopic Mass: 162.07145086g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 10
- Rotatable Bond Count: 4
- Complexity: 121
- 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: 2
- Topological Polar Surface Area: 62.6?2
Experimental Properties
- PSA: 37.3
Acetic acid, [(1,1-dimethylpropyl)thio]- Related Literature
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Adeline Huiling Loo,Alessandra Bonanni,Martin Pumera Analyst, 2013,138, 467-471
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L. Di Michele,D. Fiocco,F. Varrato,E. Eiser,G. Foffi Soft Matter, 2014,10, 3633-3648
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3. An integrated chip for immunofluorescence and its application to analyze lysosomal storage disordersJie Shen,Ying Zhou,Tu Lu,Junya Peng,Zhixiang Lin,Yuhong Pang,Li Yu Lab Chip, 2012,12, 317-324
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Yaqing Liu,Jiangtao Ren,Jing Li,Jiyang Liu,Erkang Wang Chem. Commun., 2012,48, 802-804
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Chongyang Zhu,Xiaojia Bian,Xin Jia,Ning Tang,Yongqiang Cheng Food Funct., 2020,11, 10635-10644
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