N-Cyclohexylethanolamine - ≥98%(T) , CAS No.2842-38-8

CAS: 2842-38-8 Cat. No.: N140389 分子式: C₈H₁₇NO 分子量: 143.23 Beilstein Registry Number: 1071413 EC番号: 220-636-4

GRADE & PURITY ≥98%(T)

Synonyms

MFCD00021326 | EN300-18800 | Ethanol, 2-(cyclohexylamino)- | N-Cyclohexylaminoethanol | N-Hydroxyethylcyclohexylamine | Z90504557 | D95373 | Abromeen E-25 | AKOS000121422 | N-Cyclohexylethanolamine | BRN 1071413 | SCHEMBL131659 | N-(2-Hydroxyethyl)-N-cycl

Storage

Store at 2-8°C,Argon charged

Shipped In

Wet ice

Specifications

同義語

MFCD00021326 | EN300-18800 | Ethanol, 2-(cyclohexylamino)- | N-Cyclohexylaminoethanol | N-Hydroxyethylcyclohexylamine | Z90504557 | D95373 | Abromeen E-25 | AKOS000121422 | N-Cyclohexylethanolamine | BRN 1071413 | SCHEMBL131659 | N-(2-Hydroxyethyl)-N-cycl

仕様と純度

≥98%(T)

保管条件

Store at 2-8°C,Argon charged

入荷

Wet ice

この製品は冷冷この冷このこの製品の運送が必要です。地上およびその他の経済サービスは利用できません。

純度

≥98%(T)

名前と識別子

• パブケム・シド: 504752849
• パブケム・シド・ウル: https://pubchem.ncbi.nlm.nih.gov/substance/504752849
• カノニカル・スマイル: C1CCC(CC1)NCCO
• IUPAC Name: 2-(cyclohexylamino)ethanol
• InChIKey: MGUMZJAQENFQKN-UHFFFAOYSA-N
• INCHI: 1S/C8H17NO/c10-7-6-9-8-4-2-1-3-5-8/h8-10H,1-7H2
• 異性体SMILES: C1CCC(CC1)NCCO
• RTECS: KK3530000
• 分子量: 143.23
• Beilstein: 1071413
• Reaxy-Rn: 1071413
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1071413&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic nitrogen compounds
    • 分類 Organonitrogen compounds
      • Subclass Cyclohexylamines

• Kingdom: Organic compounds
• Superclass: Organic nitrogen compounds
• 分類: Organonitrogen compounds
• Subclass: Cyclohexylamines
• Intermediate Tree Nodes: Not available
• Direct Parent: Cyclohexylamines
• Alternative Parents: 1,2-aminoalcohols Dialkylamines Primary alcohols Organopnictogen compounds Hydrocarbon derivatives
• Molecular Framework: Aliphatic homomonocyclic compounds
• Substituents: Cyclohexylamine - 1,2-aminoalcohol - Secondary amine - Secondary aliphatic amine - Alkanolamine - Organic oxygen compound - Organopnictogen compound - Hydrocarbon derivative - Primary alcohol - Organooxygen compound - Amine - Alcohol - Aliphatic homomonocyclic compound
• 説明: This compound belongs to the class of organic compounds known as cyclohexylamines. These are organic compounds containing a cyclohexylamine moiety, which consist of a cyclohexane ring attached to an amine group.
• 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

関連ターゲット（非人間）

Pseudomonas aeruginosa (123386 Activities)

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Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

作用メカニズム

化学的性質と物理的性質

• 溶解度: Soluble in water
• 感度: Air sensitive
• 屈折率: 1.48
• 沸点（°C）: 112℃/3mm
• 融点（°C）: 34-38℃
• 分子量: 143.230 g/mol
• XLogP3: 0.900
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 143.131 Da
• Monoisotopic Mass: 143.131 Da
• Topological Polar Surface Area: 32.299 Ų
• Heavy Atom Count: 10
• Formal Charge: 0
• Complexity: 79.300
• 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