(S)-(+)-4-Methyl-2-pentanol - ≥99% , CAS No.14898-80-7

CAS: 14898-80-7 Cat. No.: M710018 Formula: C₆H₁₄O Peso molecolare: 102.17 Numero EC: 623-249-2

GRADE & PURITY ≥99%

Storage

Conservare a 2-8°C

Shipped In

Ghiaccio umido

Panoramica

Viene impiegato nella reazione di acetali 2-metossietilici con allilsilani in presenza di tetracloruro di titanio: scissione regioselettiva del legame carbonio-ossigeno degli acetali asimmetrici.

Specifications

Specifiche e purezza

≥99%

Condizioni di conservazione di stoccaggio

Conservare a 2-8°C

Spedito in

Ghiaccio umido

Purezza

≥99%

Nomi e identificatori

Pubchem Sid

508817236

Sorrisi canonici

CC(C)CC(C)O

IUPAC Name

(2S)-4-methylpentan-2-ol

InChIKey

WVYWICLMDOOCFB-LURJTMIESA-N

INCHI

1S/C6H14O/c1-5(2)4-6(3)7/h5-7H,4H2,1-3H3/t6-/m0/s1

Isomeri SMILES

C[C@@H](CC(C)C)O

Numero UN

2053

Gruppo di imballaggio

III

Peso molecolare

102.17

Reaxy-Rn

1098268

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1098268&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic oxygen compounds
    • Classe Organooxygen compounds
      • Subclass Alcohols and polyols

• Kingdom: Organic compounds
• Superclass: Organic oxygen compounds
• Classe: Organooxygen compounds
• Subclass: Alcohols and polyols
• Intermediate Tree Nodes: Not available
• Direct Parent: Secondary alcohols
• Alternative Parents: Hydrocarbon derivatives
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Secondary alcohol - Hydrocarbon derivative - Aliphatic acyclic compound
• Descrizione: This compound belongs to the class of organic compounds known as secondary alcohols. These are compounds containing a secondary alcohol functional group, with the general structure HOC(R)(R') (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

Proprietà chimiche e fisiche

• Sensibilità: Heat sensitive
• Indice di rifrazione: 1.4090-1.4120
• Peso molecolare: 102.170 g/mol
• XLogP3: 1.700
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 2
• Exact Mass: 102.104 Da
• Monoisotopic Mass: 102.104 Da
• Topological Polar Surface Area: 20.200 Ų
• Heavy Atom Count: 7
• Formal Charge: 0
• Complexity: 41.400
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 1
• 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