Cyclohexanecarboxaldehyde - ≥97% , CAS No.2043-61-0

CAS: 2043-61-0 Cat. No.: C109681 분자식: C₇H₁₂O 분자량: 112.17 Beilstein Registry Number: 878306 EC 번호: 218-057-7

등급 & 순도 ≥97%

Synonyms

cyclohexylcarbaldehyde|Cyclohexanecarboxaldehyde;|Cyclohexancarboxaldehyde|cyclohexane carbaldehyde|cyclohexane carboaldehyde|Cyclohexanealdehyde|cyclohexane-aldehyde|cyclohexancarbaldehyd|cyclohexyl carboxaldehyde|Cyclohexylcarboxaldehyde|Cyclohexane-1-carboxaldehyde|Cyclohexylmethanal|Cyclohexane formaldehyde|Cyclohexanal|Cyclohexanecarbaldehyde|cyclo-hexanecarbaldehyde|cyclohexane-carbaldehyde|1-Formylcyclohexane|CYCLOHEXANE-1-ALDEHYDE|Formylcyclohexane|CYCLOHEXANECARBOXALDEHYDE|cyclohexane-carboxaldehyde|Cyclohexylformaldehyde|Hexahydrobenzaldehyde|1-Cyclohexanecarboxaldehyde|Cyclohexanaecarboxaldehyde|CYCLOHEXANE CARBOXALDEHYDE|cyclohexanecaboxaldehyde

Storage

Store at 2-8°C,Protected from light,Argon charged

Shipped In

Wet ice

개요

Employed in an aldol reaction with ethyl diazoacetate catalyzed by basic, nanoparticulate magnesium oxide leading to α-diazo-β-hydroxyesters

사양

동의어

cyclohexylcarbaldehyde | Cyclohexanecarboxaldehyde; | Cyclohexancarboxaldehyde | cyclohexane carbaldehyde | cyclohexane carboaldehyde | Cyclohexanealdehyde | cyclohexane-aldehyde | cyclohexancarbaldehyd | cyclohexyl carboxaldehyde | Cyclohexylcarboxaldehyde | Cyclohexane-1-carboxaldehyde | Cyclohexylmethanal | Cyclohexane formaldehyde | C Show more

사양 및 순도

≥97%

보관 조건

Store at 2-8°C,Protected from light,Argon charged

배송

Wet ice

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순수함

≥97%

이름과 식별자

Pubchem Sid

508814721

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/508814721

정식 스마일

C1CCC(CC1)C=O

IUPAC Name

cyclohexanecarbaldehyde

InChIKey

KVFDZFBHBWTVID-UHFFFAOYSA-N

INCHI

1S/C7H12O/c8-6-7-4-2-1-3-5-7/h6-7H,1-5H2

이성체 SMILES

C1CCC(CC1)C=O

WGK 독일

3

UN 번호

1989

분자량

112.17

Beilstein

878306

Reaxy-Rn

878306

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=878306&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic oxygen compounds
    • 분류 Organic oxides

• Kingdom: Organic compounds
• Superclass: Organic oxygen compounds
• 분류: Organic oxides
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Organic oxides
• Alternative Parents: Hydrocarbon derivatives Aldehydes
• Molecular Framework: Aliphatic homomonocyclic compounds
• Substituents: Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Aldehyde - Aliphatic homomonocyclic compound
• 설명: This compound belongs to the class of organic compounds known as organic oxides. These are organic compounds containing an oxide group.
• 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

화학 및 물리적 특성

• 용해성: Soluble in chloroform, ether, alcohol. Slightly soluble in water.
• 감도: Light sensitive;Air sensitive;light sensitive
• 굴절률: 1.449-1.452
• 발화점(°F): 105.8 °F
• 발화점(°C): 40℃
• 끓는점(°C): 159°C
• 녹는점(°C): 34-35℃
• 분자량: 112.170 g/mol
• XLogP3: 1.800
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 1
• Exact Mass: 112.089 Da
• Monoisotopic Mass: 112.089 Da
• Topological Polar Surface Area: 17.100 Ų
• Heavy Atom Count: 8
• Formal Charge: 0
• Complexity: 72.500
• 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