Cas no 89585-04-6 (Boronic acid, (2-methylpentyl)-)
89585-04-6 structure
Product Name:Boronic acid, (2-methylpentyl)-
CAS No:89585-04-6
MF:C6H15BO2
MW:129.993102312088
CID:595742
PubChem ID:4188607
Update Time:2025-04-19
Boronic acid, (2-methylpentyl)- Chemical and Physical Properties
Names and Identifiers
-
- Boronic acid, (2-methylpentyl)-
- 2-methylpentylboronic acid
- (2-Methylpentyl)boronic acid
- 89585-04-6
- AKOS013012685
- DTXSID10400532
-
- Inchi： 1S/C6H15BO2/c1-3-4-6(2)5-7(8)9/h6,8-9H,3-5H2,1-2H3
- InChI Key： FYDSTEQOOILTOM-UHFFFAOYSA-N
- SMILES： OB(CC(C)CCC)O
Computed Properties
- Exact Mass: 130.117
- Monoisotopic Mass: 130.117
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 9
- Rotatable Bond Count: 4
- Complexity: 66.1
- 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
- Topological Polar Surface Area: 40.5A^2
Experimental Properties
- PSA: 40.46000
- LogP: 0.89540
Boronic acid, (2-methylpentyl)- Related Literature
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J. Matthew Kurley,Phillip W. Halstenberg,Abbey McAlister,Stephen Raiman,Richard T. Mayes RSC Adv., 2019,9, 25602-25608
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Yong Ping Huang,Tao Tao,Zheng Chen,Wei Han,Ying Wu,Chunjiang Kuang,Shaoxiong Zhou,Ying Chen J. Mater. Chem. A, 2014,2, 18831-18837
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Gaurav J. Shah,Eric P.-Y. Chiou,Ming C. Wu,Chang-Jin “CJ” Kim Lab Chip, 2009,9, 1732-1739
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Tao Wang,Yangyang Liu,Yue Deng,Hongbo Fu,Jianmin Chen Environ. Sci.: Nano, 2018,5, 1821-1833
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Alexandre Vimont,Arnaud Travert,Philippe Bazin,Jean-Claude Lavalley,Marco Daturi,Christian Serre,Gérard Férey,Sandrine Bourrelly,Philip L. Llewellyn Chem. Commun., 2007, 3291-3293
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