2,2-Dimetil-3-morfolin-4-ilpropanal - ≥97% , CAS No.23588-51-4

CAS: 23588-51-4 Cat. No.: D168877 Fórmula: C₉H₁₇NO₂ Peso molecular: 171.24 Número CE: 700-569-1

GRADE & PURITY ≥97%

Synonyms

2,2-Dimetil-3-(4-morfolinil)propanal | SCHEMBL342075 | 2,2-Dimetil-3-(morfolin-4-il)propanal | MFCD00457348 | 2,2-Dimetil-3-morfolinopropanal | 2,2-Dimetil-3-morfolino-propanal | 2,2-Dimetil-3-morfolin-4-ilpropanal, AldrichCPR | AKOS005171389 |

Storage

Temperatura ambiente

Shipped In

Normal

Specifications

Sinónimos

2,2-Dimetil-3-(4-morfolinil)propanal | SCHEMBL342075 | 2,2-Dimetil-3-(morfolin-4-il)propanal | MFCD00457348 | 2,2-Dimetil-3-morfolinopropanal | 2,2-Dimetil-3-morfolino-propanal | 2,2-Dimetil-3-morfolin-4-ilpropanal, AldrichCPR | AKOS005171389 |

Especificações e pureza

≥97%

Condições de armazenamento de armazenamento

Temperatura ambiente

Enviado em

Normal

Pureza

≥97%

Nomes e identificadores

Pubchem Sid

488194315

Sorrisos canónicos

CC(C)(CN1CCOCC1)C=O

IUPAC Name

2,2-dimethyl-3-morpholin-4-ylpropanal

InChIKey

KVOOZKISXYTWCJ-UHFFFAOYSA-N

INCHI

1S/C9H17NO2/c1-9(2,8-11)7-10-3-5-12-6-4-10/h8H,3-7H2,1-2H3

SMILES isoméricas

CC(C)(CN1CCOCC1)C=O

WGK Alemanha

3

Peso molecular

171.24

Reaxy-Rn

122954

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=122954&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 Organic oxides Hydrocarbon derivatives Aldehydes
• Molecular Framework: Aliphatic heteromonocyclic compounds
• Substituents: Morpholine - Tertiary amine - Tertiary aliphatic amine - Dialkyl ether - Ether - Azacycle - Oxacycle - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Aldehyde - Organic oxide - Amine - Carbonyl group - Hydrocarbon derivative - Aliphatic heteromonocyclic compound
• Descrição: 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

Propriedades químicas e físicas

• Peso molecular: 171.240 g/mol
• XLogP3: 0.300
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 171.126 Da
• Monoisotopic Mass: 171.126 Da
• Topological Polar Surface Area: 29.500 Ų
• Heavy Atom Count: 12
• Formal Charge: 0
• Complexity: 151.000
• 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

Perguntas frequentes

What is the purity of this product?

This product is supplied at ≥97% 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 23588-51-4, the molecular formula is C9H17NO2, and the molecular weight is 171.24 g/mol. InChIKey KVOOZKISXYTWCJ-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.