Cas no 82189-55-7 (3-Buten-1-ol, 2,3-dimethyl-, (S)-)
82189-55-7 structure
Product Name:3-Buten-1-ol, 2,3-dimethyl-, (S)-
CAS No:82189-55-7
MF:C6H12O
MW:100.158882141113
CID:696081
PubChem ID:71419626
Update Time:2025-04-19
3-Buten-1-ol, 2,3-dimethyl-, (S)- Chemical and Physical Properties
Names and Identifiers
-
- 3-Buten-1-ol, 2,3-dimethyl-, (S)-
- 82189-55-7
- (2S)-2,3-Dimethylbut-3-en-1-ol
- SCHEMBL16203095
- DTXSID20838862
-
- Inchi： 1S/C6H12O/c1-5(2)6(3)4-7/h6-7H,1,4H2,2-3H3/t6-/m1/s1
- InChI Key： OSUIFWPTEFZCMB-ZCFIWIBFSA-N
- SMILES： OC[C@@H](C)C(=C)C
Computed Properties
- Exact Mass: 100.088815002g/mol
- Monoisotopic Mass: 100.088815002g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 7
- Rotatable Bond Count: 2
- Complexity: 66.6
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 1
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 1.6
- Topological Polar Surface Area: 20.2?2
3-Buten-1-ol, 2,3-dimethyl-, (S)- Related Literature
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Dan Yang,Yanping Zhou,Xianhong Rui,Jixin Zhu,Ziyang Lu,Eileen Fong,Qingyu Yan RSC Adv., 2013,3, 14960-14962
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Joseph H. Bisesi,Tara Sabo-Attwood Environ. Sci.: Nano, 2014,1, 574-583
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3. Excimer emission and magnetoluminescence of radical-based zinc(ii) complexes doped in host crystals?Shojiro Kimura,Tetsuro Kusamoto Chem. Commun., 2020,56, 11195-11198
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Goonay Yousefalizadeh,Shideh Ahmadi,Nicholas J. Mosey,Kevin G. Stamplecoskie Nanoscale, 2021,13, 242-252
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