2-シクロヘキシルエチルアミン - ≥97% , CAS No.4442-85-7

CAS: 4442-85-7 Cat. No.: C153966 分子式: C₈H₁₇N 分子量: 127.23 EC番号: 224-673-7

GRADE & PURITY ≥97%

Synonyms

2-CYCLOHEXYL-ETHYLAMINE HYDROCHLORIDE｜EINECS 224-673-7｜SCEMBL79025｜Cyclohexaneethanamine (9CI)｜WLN: L6TJ A2Z｜MFCD00058668｜NSC 59005｜EN300-35782｜DTXSID60196170｜Cyclohexaneethylamine｜4-12-00-00133 (Beilstein Handbook Reference)｜HFACYW

Storage

Argon charged,Room temperature

Shipped In

ノーマル

Specifications

同義語

2-CYCLOHEXYL-ETHYLAMINE HYDROCHLORIDE｜EINECS 224-673-7｜SCEMBL79025｜Cyclohexaneethanamine (9CI)｜WLN: L6TJ A2Z｜MFCD00058668｜NSC 59005｜EN300-35782｜DTXSID60196170｜Cyclohexaneethylamine｜4-12-00-00133 (Beilstein Handbook Reference)｜HFACYW

仕様と純度

≥97%

保管条件

Argon charged,Room temperature

入荷

ノーマル

純度

≥97%

名前と識別子

パブケム・シド

504752985

パブケム・シド・ウル

https://pubchem.ncbi.nlm.nih.gov/substance/504752985

カノニカル・スマイル

C1CCC(CC1)CCN

IUPAC Name

2-cyclohexylethanamine

InChIKey

HFACYWDPMNWMIW-UHFFFAOYSA-N

INCHI

1S/C8H17N/c9-7-6-8-4-2-1-3-5-8/h8H,1-7,9H2

異性体SMILES

C1CCC(CC1)CCN

RTECS

KR3325000

分子量

127.23

Reaxy-Rn

2689115

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2689115&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic nitrogen compounds
    • 分類 Organonitrogen compounds
      • Subclass Amines
        • Level5 Primary amines
          • Level6 Monoalkylamines

• Kingdom: Organic compounds
• Superclass: Organic nitrogen compounds
• 分類: Organonitrogen compounds
• Subclass: Amines
• Intermediate Tree Nodes: Primary amines
• Direct Parent: Monoalkylamines
• Alternative Parents: Organopnictogen compounds Hydrocarbon derivatives
• Molecular Framework: Aliphatic homomonocyclic compounds
• Substituents: Organopnictogen compound - Hydrocarbon derivative - Primary aliphatic amine - Aliphatic homomonocyclic compound
• 説明: This compound belongs to the class of organic compounds known as monoalkylamines. These are organic compounds containing an primary aliphatic 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

作用メカニズム

化学的性質と物理的性質

• 感度: air sensitive
• 屈折率: 1.46
• 引火点（°C）: 51 °C
• 沸点（°C）: 96°C/40mmHg(lit.)
• 分子量: 127.230 g/mol
• XLogP3: 2.400
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 2
• Exact Mass: 127.136 Da
• Monoisotopic Mass: 127.136 Da
• Topological Polar Surface Area: 26.000 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

よくある質問

What is the purity of this product?

This product is supplied at ≥97% purity (chemical assay). Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store at room temperature under argon. It is supplied under an argon blanket; reseal under inert gas after each use.

How is this product shipped?

This product ships under standard ambient conditions. No temperature-controlled packaging is required.

What are the CAS number, molecular formula and molecular weight?

The CAS Number is 4442-85-7, the molecular formula is C8H17N, and the molecular weight is 127.23 g/mol. InChIKey HFACYWDPMNWMIW-UHFFFAOYSA-N.

What documentation is provided?

Available product documentation, including Certificates of Analysis (COA), Safety Data Sheets (SDS), and specification sheets, is shown in the product document area. Document availability and access follow the current site policy.