(2-Methylpropyl)boronsäure - ≥95% , CAS No.84110-40-7

CAS: 84110-40-7 Cat. No.: M299536 Summenformel: C₄H₁₁BO₂ Molekulargewicht: 101.94 Beilstein Registry Number: 4(3)1965 EG-Nummer: 617-531-4

GRADE & PURITY ≥95%

Synonyms

AB03722 | MFCD00134156 | 2-methylpropaneboronic acid | B-(2-Methylpropyl)boronic acid | IsobutylboronicAcid | (2-Methylpropyl)boronic acid | 2-Methylpropylboroic acid | Isobutaneboronic acid | i-BuB(OH)2 | EN300-74361 | (2-Methylpropyl)boronicacid | AKOS0

Storage

Argon charged,Room temperature

Shipped In

Normal

Specifications

Synonyme

AB03722 | MFCD00134156 | 2-methylpropaneboronic acid | B-(2-Methylpropyl)boronic acid | IsobutylboronicAcid | (2-Methylpropyl)boronic acid | 2-Methylpropylboroic acid | Isobutaneboronic acid | i-BuB(OH)2 | EN300-74361 | (2-Methylpropyl)boronicacid | AKOS0

Spezifikationen & Reinheit

≥95%

Storage

Argon charged,Room temperature

Verschickt in

Normal

Reinheit

≥95%

Namen und Kennungen

• Pubchem Sid: 504761127
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504761127
• Kanonisches Lächeln: B(CC(C)C)(O)O
• IUPAC Name: 2-methylpropylboronic acid
• InChIKey: ZAZPDOYUCVFPOI-UHFFFAOYSA-N
• INCHI: 1S/C4H11BO2/c1-4(2)3-5(6)7/h4,6-7H,3H2,1-2H3
• Isomere SMILES: B(CC(C)C)(O)O
• WGK Deutschland: 3
• Molekulargewicht: 101.94
• Beilstein: 4(3)1965
• Reaxy-Rn: 1697496
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1697496&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic acids and derivatives
    • Klasse Boronic acid derivatives
      • Subclass Boronic acids

• Kingdom: Organic compounds
• Superclass: Organic acids and derivatives
• Klasse: Boronic acid derivatives
• Subclass: Boronic acids
• Intermediate Tree Nodes: Not available
• Direct Parent: Boronic acids
• Alternative Parents: Organic metalloid salts Organic oxygen compounds Monoalkylboranes Hydrocarbon derivatives
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Boronic acid - Organic metalloid salt - Organic oxygen compound - Monoalkylborane - Alkylborane - Hydrocarbon derivative - Organic salt - Organoboron compound - Aliphatic acyclic compound
• Beschreibung: This compound belongs to the class of organic compounds known as boronic acids. These are compounds comprising the boronic acid functional group RB(O)O (R,R'=alkyl, aryl).
• External Descriptors: Not available

Data sources

1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.

DOI: 10.1186/s13321-016-0174-y

Chemische und physikalische Eigenschaften

• Empfindlichkeit: Moisture sensitive.
• Schmelzpunkt (°C): 108-110°C
• Molekulargewicht: 101.940 g/mol
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 102.085 Da
• Monoisotopic Mass: 102.085 Da
• Topological Polar Surface Area: 40.500 Ų
• Heavy Atom Count: 7
• Formal Charge: 0
• Complexity: 45.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1

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