4-(2-Hydroxyethyl)morpholine - ≥99% , CAS No.622-40-2

CAS: 622-40-2 Cat. No.: H100457 Molecular Weight: 131.17 Beilstein Registry Number: 104375 EC Number: 210-734-5

GRADE & PURITY ≥99%

Synonyms

N-.beta.-Hydroxyethylmorpholine | Tox21_302022 | 2-(4-Morpholinyl)ethanol | 2-hydroxylethylmorpholine | STK803089 | 4-(2-hydroxyethyl)-morphline | CHEBI:67144 | N-hydroxyethylmorpholine | AMY9419 | hydroxyethyl morpholine | 2-(4-Morpholinyl)-1-ethanol | I

Storage

Store at 2-8°C,Argon charged

Shipped In

Wet ice

Overview

4-(2-Hydroxyethyl)morpholine is used as an organic chemical synthesis intermediate.

Specifications

Synonyms

N-.beta.-Hydroxyethylmorpholine | Tox21_302022 | 2-(4-Morpholinyl)ethanol | 2-hydroxylethylmorpholine | STK803089 | 4-(2-hydroxyethyl)-morphline | CHEBI:67144 | N-hydroxyethylmorpholine | AMY9419 | hydroxyethyl morpholine | 2-(4-Morpholinyl)-1-ethanol | I

Specifications & Purity

≥99%

Storage

Store at 2-8°C, Argon charged

Shipped In

Wet ice

This product requires cold chain shipping. Ground and other economy services are not available.

Purity

≥99%

Names and Identifiers

• Pubchem Sid: 504753748
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504753748
• Canonical Smiles: C1COCCN1CCO
• IUPAC Name: 2-morpholin-4-ylethanol
• InChIKey: KKFDCBRMNNSAAW-UHFFFAOYSA-N
• INCHI: 1S/C6H13NO2/c8-4-1-7-2-5-9-6-3-7/h8H,1-6H2
• Isomeric SMILES: C1COCCN1CCO
• WGK Germany: 1
• RTECS: QE3510000
• Molecular Weight: 131.17
• Beilstein: 104375
• Reaxy-Rn: 104375
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=104375&ln=

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Class: Oxazinanes
• Subclass: Morpholines
• Intermediate Tree Nodes: Not available
• Direct Parent: Morpholines
• Alternative Parents: Trialkylamines 1,2-aminoalcohols Oxacyclic compounds Dialkyl ethers Azacyclic compounds Primary alcohols Organopnictogen compounds Hydrocarbon derivatives
• Molecular Framework: Aliphatic heteromonocyclic compounds
• Substituents: Morpholine - 1,2-aminoalcohol - Tertiary aliphatic amine - Tertiary amine - Alkanolamine - Dialkyl ether - Ether - Oxacycle - Azacycle - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - Primary alcohol - Hydrocarbon derivative - Organopnictogen compound - Amine - Organic oxygen compound - Alcohol - Aliphatic heteromonocyclic compound
• Description: 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: tertiary amino compound - primary alcohol - morpholines

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

Mechanisms of Action

Chemical and Physical Properties

• Solubility: Fully miscible in water.
• Sensitivity: Sensitive to air&light&heat
• Refractive Index: 1.4775
• Flash Point(°F): 208.4 °F
• Flash Point(°C): 98 °C
• Boil Point(°C): 222°C
• Melt Point(°C): 2°C(lit.)
• Molecular Weight: 131.170 g/mol
• XLogP3: -0.800
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 131.095 Da
• Monoisotopic Mass: 131.095 Da
• Topological Polar Surface Area: 32.700 Ų
• Heavy Atom Count: 9
• Formal Charge: 0
• Complexity: 71.500
• 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

References

1. Ruizhi Pang, Kaisong Zhang.  (2017)  High-flux polyamide reverse osmosis membranes by surface grafting 4-(2-hydroxyethyl)morpholine.  RSC Advances,  7  (65): (40705-40710).  [PMID:] [10.1039/C7RA06486A]