Methyl 4-morpholinepropionate - ≥98% , CAS No.33611-43-7

CAS: 33611-43-7 Cat. No.: M169674 Formule: C₈H₁₅NO₃ Poids moléculaire: 173.21 Numéro CE: 626-796-5

GRADE & PURITY ≥98%

Synonyms

DB00228 | Methyl4-morpholinepropionate | 3-morpholin-4-yl-propionic acid methyl ester | A821874 | 4-(2-(METHOXYCARBONYL)ETHYL)MORPHOLINE | SY013056 | Methyl 3-(4-morpholinyl)propanoate # | Methyl 3-morpholinopropanoate | methyl 3-mor-pholinopropanoate | A

Storage

Room temperature

Shipped In

Normal

Specifications

Synonymes

DB00228 | Methyl4-morpholinepropionate | 3-morpholin-4-yl-propionic acid methyl ester | A821874 | 4-(2-(METHOXYCARBONYL)ETHYL)MORPHOLINE | SY013056 | Methyl 3-(4-morpholinyl)propanoate # | Methyl 3-morpholinopropanoate | methyl 3-mor-pholinopropanoate | A

Spécifications et pureté

≥98%

Conditions de stockage de stockage

Room temperature

Expédié en

Normal

Pureté

≥98%

Noms et identifiants

• Pubchem Sid: 488187260
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488187260
• Sourires canoniques: COC(=O)CCN1CCOCC1
• IUPAC Name: methyl 3-morpholin-4-ylpropanoate
• InChIKey: YMSLLIGKMYXCPK-UHFFFAOYSA-N
• INCHI: 1S/C8H15NO3/c1-11-8(10)2-3-9-4-6-12-7-5-9/h2-7H2,1H3
• Isomères SMILES: COC(=O)CCN1CCOCC1
• WGK Allemagne: 3
• Poids moléculaire: 173.21
• Reaxy-Rn: 1073166
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1073166&ln=

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Classe: Oxazinanes
• Subclass: Morpholines
• Intermediate Tree Nodes: Not available
• Direct Parent: Morpholines
• Alternative Parents: Methyl esters Trialkylamines Amino acids and derivatives Oxacyclic compounds Monocarboxylic acids and derivatives Dialkyl ethers Azacyclic compounds Organopnictogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic heteromonocyclic compounds
• Substituents: Morpholine - Methyl ester - Amino acid or derivatives - Carboxylic acid ester - Tertiary amine - Tertiary aliphatic amine - Carboxylic acid derivative - Dialkyl ether - Ether - Monocarboxylic acid or derivatives - Oxacycle - Azacycle - Organopnictogen compound - Carbonyl group - Organic nitrogen compound - Amine - Organonitrogen compound - Organooxygen compound - Organic oxide - Hydrocarbon derivative - Organic oxygen compound - 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: 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

Propriétés chimiques et physiques

• Point d'éclair (°F): 219.2 °F
• Point d'éclair (°C): 104 °C
• Poids moléculaire: 173.210 g/mol
• XLogP3: -0.300
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 4
• Exact Mass: 173.105 Da
• Monoisotopic Mass: 173.105 Da
• Topological Polar Surface Area: 38.800 Ų
• Heavy Atom Count: 12
• Formal Charge: 0
• Complexity: 143.000
• 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

Foire aux questions

What is the purity of this product?

This product is supplied at ≥98% purity (chemical assay). Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store at room temperature.

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 33611-43-7, the molecular formula is C8H15NO3, and the molecular weight is 173.21 g/mol. InChIKey YMSLLIGKMYXCPK-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.