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

CAS: 696-57-1 Cat. No.: A151028 分子式: C₇H₁₃NO 分子量: 127.19 EC番号: 672-720-9

グレード＆純度 ≥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

仕様

同義語

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 もっと見る

仕様と純度

≥97%(GC)

保管条件

Room temperature

入荷

Normal

純度

≥97%(GC)

名前と識別子

パブケム・シド

504757075

パブケム・シド・ウル

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

カノニカル・スマイル

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

異性体SMILES

C=CCN1CCOCC1

分子量

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
    • 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: 1.46
• 引火点（°C）: 43 °C
• 沸点（°C）: 158°C(lit.)
• 分子量: 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

よくある質問

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.