4-Allylmorpholine - ≥97%(GC) , CAS No.696-57-1

CAS: 696-57-1 Cat. No.: A151028 Formule: C₇H₁₃NO Poids moléculaire: 127.19 Numéro CE: 672-720-9

QUALITÉ & PURETÉ ≥97%(GC)

Synonyms

allyl morpholine|N-Allymorpholine|4-(2-propenyl)morpholine|Morpholine, 4-allyl-|4-Allylmorpholine, >/=97%|4-Allylmorpholine|4-allyl-morpholine|Morpholine, 4-(2-propenyl)-|N-Allylmorpholine|4-(prop-2-en-1-yl)morpholine|4-Allylmorpholine #|BIS(4-NITROPHENYL)PHOSPHATEHYDRATE|Allylmorpholine|N-Allyl morpholine|4-prop-2-enylmorpholine

Storage

Room temperature

Shipped In

Normal

Spécifications

Synonymes

allyl morpholine | N-Allymorpholine | 4-(2-propenyl)morpholine | Morpholine, 4-allyl- | 4-Allylmorpholine, >/=97% | 4-Allylmorpholine | 4-allyl-morpholine | Morpholine, 4-(2-propenyl)- | N-Allylmorpholine | 4-(prop-2-en-1-yl)morpholine | 4-Allylmorpholine # | BIS(4-NITROPHENYL)PHOSPHATEHYDRATE | Allylmorpholine | N-Allyl morpholine | 4-pr Afficher plus

Spécifications et pureté

≥97%(GC)

Conditions de stockage de stockage

Room temperature

Expédié en

Normal

Pureté

≥97%(GC)

Noms et identifiants

Pubchem Sid

504757075

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/504757075

Sourires canoniques

C=CCN1CCOCC1

IUPAC Name

4-prop-2-enylmorpholine

InChIKey

SUSANAYXICMXBL-UHFFFAOYSA-N

INCHI

1S/C7H13NO/c1-2-3-8-4-6-9-7-5-8/h2H,1,3-7H2

Isomères SMILES

C=CCN1CCOCC1

Poids moléculaire

127.19

Reaxy-Rn

109058

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=109058&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: 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
• 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

• Indice de réfraction: 1.46
• Point d'éclair (°C): 43 °C
• Point d'ébullition (°C): 158°C(lit.)
• Poids moléculaire: 127.180 g/mol
• XLogP3: 0.500
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 127.1 Da
• Monoisotopic Mass: 127.1 Da
• Topological Polar Surface Area: 12.500 Ų
• Heavy Atom Count: 9
• Formal Charge: 0
• Complexity: 86.900
• 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, and how is it determined?

This product is supplied at ≥97% purity, determined by gas chromatography (GC). 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 696-57-1, the molecular formula is C7H13NO, and the molecular weight is 127.19 g/mol. InChIKey SUSANAYXICMXBL-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.