Cyclohexaneethanol - ≥98% , CAS No.4442-79-9

CAS: 4442-79-9 Cat. No.: C153306 分子式: C₈H₁₆O 分子量: 128.22 EC番号: 224-672-1

グレード＆純度 ≥98%

Synonyms

2-CYCLOHEXANEETHANOL|2-Cyclohexylethanol|2-cyclohexyl-ethanol|Cyclohexylethanol;Cyclohexylethyl alcohol;(2-Hydroxyethyl)cyclohexane|2-Cyclohexylethyl alcohol|2-Cyclohexylethan-1-Ol|.beta.-Cyclohexyl ethanol|CYCLOHEXYLETHANOL [INCI]|(2-Hydroxyethyl)cyclohexane|CYCLOHEXANEETHANOL|Cyclohexane-ethanol|Cyclohexylethanol|Ethanol, 2-cyclohexyl-|2-(cyclohexyl)ethanol|2-cyclohexyl-1-ethanol|Cyclohexylethyl alcohol|.beta.-Cyclohexylethyl alcohol

Storage

Room temperature

Shipped In

Normal

仕様

同義語

2-CYCLOHEXANEETHANOL | 2-Cyclohexylethanol | 2-cyclohexyl-ethanol | Cyclohexylethanol;Cyclohexylethyl alcohol;(2-Hydroxyethyl)cyclohexane | 2-Cyclohexylethyl alcohol | 2-Cyclohexylethan-1-Ol | .beta.-Cyclohexyl ethanol | CYCLOHEXYLETHANOL [INCI] | (2-Hydroxyethyl)cyclohexane | CYCLOHEXANEETHANOL | Cyclohexane-ethanol | Cyclohexylethanol | もっと見る

仕様と純度

≥98%

保管条件

Room temperature

入荷

Normal

純度

≥98%

名前と識別子

パブケム・シド

488182627

パブケム・シド・ウル

https://pubchem.ncbi.nlm.nih.gov/substance/488182627

カノニカル・スマイル

C1CCC(CC1)CCO

IUPAC Name

2-cyclohexylethanol

InChIKey

QJQZRLXDLORINA-UHFFFAOYSA-N

INCHI

1S/C8H16O/c9-7-6-8-4-2-1-3-5-8/h8-9H,1-7H2

異性体SMILES

C1CCC(CC1)CCO

WGKドイツ

3

RTECS

KK3528000

分子量

128.22

Reaxy-Rn

1848152

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1848152&ln=

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Organic oxygen compounds
• 分類: Organooxygen compounds
• Subclass: Alcohols and polyols
• Intermediate Tree Nodes: Not available
• Direct Parent: Primary alcohols
• Alternative Parents: Hydrocarbon derivatives
• Molecular Framework: Aliphatic homomonocyclic compounds
• Substituents: Hydrocarbon derivative - Primary alcohol - Aliphatic homomonocyclic compound
• 説明: This compound belongs to the class of organic compounds known as primary alcohols. These are compounds comprising the primary alcohol functional group, with the general structure RCOH (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

化学的性質と物理的性質

• 溶解度: Soluble in alcohol and dipropylene glycol. Soluble in water (1750 mg/L at 25°C).
• 屈折率: 1.47
• 引火点（°F）: 186.8 °F
• 引火点（°C）: 86°C(lit.)
• 沸点（°C）: 206 °C
• 融点（°C）: -20°C
• 分子量: 128.210 g/mol
• XLogP3: 2.600
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 2
• Exact Mass: 128.12 Da
• Monoisotopic Mass: 128.12 Da
• Topological Polar Surface Area: 20.200 Ų
• Heavy Atom Count: 9
• Formal Charge: 0
• Complexity: 65.000
• 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