Cas no 64604-94-0 (2-(2-methylphenyl)ethylboronic Acid)
64604-94-0 structure
Product Name:2-(2-methylphenyl)ethylboronic Acid
CAS No:64604-94-0
MF:C9H13BO2
MW:164.009322881699
CID:2792399
PubChem ID:4361790
Update Time:2025-04-21
2-(2-methylphenyl)ethylboronic Acid Chemical and Physical Properties
Names and Identifiers
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- 64604-94-0
- AKOS006275278
- (2-Methylphenethyl)boronic acid
- BDBM50282572
- DTXSID60402369
- 2-(2-Methylphenyl)ethyl boronic acid
- starbld0019229
- CHEMBL21503
- 2-(2-methylphenyl)ethylboronic Acid
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- Inchi： 1S/C9H13BO2/c1-8-4-2-3-5-9(8)6-7-10(11)12/h2-5,11-12H,6-7H2,1H3
- InChI Key： SWHKCKLSVWHSED-UHFFFAOYSA-N
- SMILES： OB(CCC1C=CC=CC=1C)O
Computed Properties
- Exact Mass: 164.1008598Da
- Monoisotopic Mass: 164.1008598Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 12
- Rotatable Bond Count: 3
- Complexity: 128
- 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
- Topological Polar Surface Area: 40.5?2
2-(2-methylphenyl)ethylboronic Acid Related Literature
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Yukiya Kitayama Polym. Chem., 2014,5, 2784-2792
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Christopher B. Rodell,Christopher B. Highley,Minna H. Chen,Neville N. Dusaj,Chao Wang,Lin Han,Jason A. Burdick Soft Matter, 2016,12, 7839-7847
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Norihito Fukui,Keisuke Fujimoto,Hideki Yorimitsu,Atsuhiro Osuka Dalton Trans., 2017,46, 13322-13341
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Eléonore Resongles,Corinne Casiot,Fran?oise Elbaz-Poulichet,Rémi Freydier,Odile Bruneel,Christine Piot,Sophie Delpoux,Aurélie Volant,Angélique Desoeuvre Environ. Sci.: Processes Impacts, 2013,15, 1536-1544
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Erika A. Cobar,Paul R. Horn,Robert G. Bergman,Martin Head-Gordon Phys. Chem. Chem. Phys., 2012,14, 15328-15339
64604-94-0 (2-(2-methylphenyl)ethylboronic Acid) Related Products
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