(R)-(−)-2-Decanol - ≥97%(HPLC),≥97%(ee) , CAS No.33758-15-5

CAS: 33758-15-5 Cat. No.: R471753 Molecular Weight: 158.28

Synonyms

(4r)-methylnonan-1-ol | CHEBI:195930 | (2R)-2-decanol | (r)-2-decanol | 2-Decanol, (-)- | (R,S)-Decan-2-ol | LMFA05000509 | (R)-(-)-2-Decanol | (R)-()-2-Decanol | FF9JDF6X5M | UNII-FF9JDF6X5M | J-019318 | (R)-(-)-2-Decanol, 97%, optical purity97% (ee) (HP

Storage

Room temperature

Overview

Description

(R)-(−)-2-Decanol can be used as a chiral inductor in photoelectrocyclization of tropolone methyl ether.

Specifications

Synonyms

(4r)-methylnonan-1-ol | CHEBI:195930 | (2R)-2-decanol | (r)-2-decanol | 2-Decanol, (-)- | (R, S)-Decan-2-ol | LMFA05000509 | (R)-(-)-2-Decanol | (R)-()-2-Decanol | FF9JDF6X5M | UNII-FF9JDF6X5M | J-019318 | (R)-(-)-2-Decanol, 97%, optical purity97% (ee) (HP

Specifications & Purity

≥97%(HPLC), ≥97%(ee)

Storage

Room temperature

Names and Identifiers

• Canonical Smiles: CCCCCCCCC(C)O
• IUPAC Name: (2R)-decan-2-ol
• InChIKey: ACUZDYFTRHEKOS-SNVBAGLBSA-N
• INCHI: 1S/C10H22O/c1-3-4-5-6-7-8-9-10(2)11/h10-11H,3-9H2,1-2H3/t10-/m1/s1
• Isomeric SMILES: CCCCCCCC[C@@H](C)O
• WGK Germany: 3
• Molecular Weight: 158.28
• Reaxy-Rn: 1719664
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1719664&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Lipids and lipid-like molecules
    • Class Fatty Acyls
      • Subclass Fatty alcohols

• Kingdom: Organic compounds
• Superclass: Lipids and lipid-like molecules
• Class: Fatty Acyls
• Subclass: Fatty alcohols
• Intermediate Tree Nodes: Not available
• Direct Parent: Fatty alcohols
• Alternative Parents: Secondary alcohols Hydrocarbon derivatives
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Fatty alcohol - Secondary alcohol - Organic oxygen compound - Hydrocarbon derivative - Organooxygen compound - Alcohol - Aliphatic acyclic compound
• Description: This compound belongs to the class of organic compounds known as fatty alcohols. These are aliphatic alcohols consisting of a chain of a least six carbon atoms.
• External Descriptors: Fatty alcohols

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

Chemical and Physical Properties

• Flash Point(°F): 185 °F
• Flash Point(°C): 85 °C
• Molecular Weight: 158.280 g/mol
• XLogP3: 4.000
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 7
• Exact Mass: 158.167 Da
• Monoisotopic Mass: 158.167 Da
• Topological Polar Surface Area: 20.200 Ų
• Heavy Atom Count: 11
• Formal Charge: 0
• Complexity: 71.300
• 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