4-Methylmorpholine - BioReagent, for protein sequencing, ≥99.5%(GC) , CAS No.109-02-4

CAS: 109-02-4 Cat. No.: M755579 分子式: C₅H₁₁NO 分子量: 101.15 Beilstein Registry Number: 102719 EC番号: 203-640-0

グレード＆純度 BioReagent, for Protein sequencing, ≥99.5%(GC)

Storage

Room temperature

Shipped In

FedEx DG Service

概要

• Effect of morpholine, and 4-methylmorpholine on urethane formation: a computational study: This paper explores the role of 4-methylmorpholine in urethane synthesis, highlighting its utility in enhancing reaction efficiencies within computational models (Waleed et al., 2023).


• Design, Synthesis, Characterization, and In Vitro Evaluation of a New Cross-Linked Hyaluronic Acid for Pharmaceutical and Cosmetic Applications: Incorporates 4-methylmorpholine in the design and synthesis of new hyaluronic acid formulations, underscoring its role in developing innovative pharmaceutical and cosmetic products (Sciabica et al., 2021).

仕様

仕様と純度

BioReagent, for protein sequencing, ≥99.5%(GC)

保管条件

Room temperature

入荷

FedEx DG Service

等級

BioReagent, タンパク質の配列決定のために

純度

≥99.5%(GC)

名前と識別子

PH

10.6 (20 °C, 50 g/L)

カノニカル・スマイル

CN1CCOCC1

IUPAC Name

4-methylmorpholine

InChIKey

SJRJJKPEHAURKC-UHFFFAOYSA-N

INCHI

1S/C5H11NO/c1-6-2-4-7-5-3-6/h2-5H2,1H3

異性体SMILES

CN1CCOCC1

WGKドイツ

1

RTECS

QE5775000

UN番号

2535

包装グループ

II

分子量

101.15

Beilstein

102719

Reaxy-Rn

102719

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=102719&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • 分類 Oxazinanes
      • Subclass Morpholines

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• 分類: Oxazinanes
• Subclass: Morpholines
• Intermediate Tree Nodes: Not available
• Direct Parent: Morpholines
• Alternative Parents: Trialkylamines Oxacyclic compounds Dialkyl ethers Azacyclic compounds Organopnictogen compounds Hydrocarbon derivatives
• Molecular Framework: Aliphatic heteromonocyclic compounds
• Substituents: Morpholine - Tertiary aliphatic amine - Tertiary amine - Oxacycle - Azacycle - Ether - Dialkyl ether - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Amine - Aliphatic heteromonocyclic compound
• 説明: This compound belongs to the class of organic compounds known as morpholines. These are organic compounds containing a morpholine moiety, which consists of a six-member aliphatic saturated ring with the formula C4H9NO, where the oxygen and nitrogen atoms lie at positions 1 and 4, respectively.
• 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

• 屈折率: 1.4332
• 引火点（°C）: 12℃
• 沸点（°C）: 111-114°C
• 融点（°C）: -65°C
• 分子量: 101.150 g/mol
• XLogP3: -0.300
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 0
• Exact Mass: 101.084 Da
• Monoisotopic Mass: 101.084 Da
• Topological Polar Surface Area: 12.500 Ų
• Heavy Atom Count: 7
• Formal Charge: 0
• Complexity: 50.000
• 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