Cyclopentanecarboxaldehyde - ≥98%, contains 0.1% hydroquinone as stabilizer , CAS No.872-53-7

CAS: 872-53-7 Cat. No.: C122650 分子式: C₅H₉CHO 分子量: 98.14 EC番号: 212-829-7

GRADE & PURITY ≥98%, contains 0.1% hydroquinone as stabilizer

Synonyms

Cyclopentanecarbaldehyde, 0.1% hydroquinone as stabilizer | cyclopentanecaboxaldehyde | C3019 | Formylcyclopentane | Cyclopentanecarbaldehyde | EN300-57255 | Cyclopentanecarboxaldehyde (25ppm 1,4-Benzoquinone as stabiliser) | BBL100156 | Cyclopentanealdeh

Storage

Store at 2-8°C,Argon charged

Shipped In

Wet ice

概要

Cyclopentanecarboxaldehyde can be prepared from cyclohexene, via copper-catalyzed oxidation with persulfate. It can also be synthesized from mercuric sulfate and cyclohexene.

Cyclopentanecarboxaldehyde may be used in the synthesis of:

· D,L-trans-2-cyclopentylmethylene-1-nitroso-1-(2-hydroxycyclohexyl)hydrazine

· ethyl 5-cyclopentyl-5-hydroxy-2-pentenoate

· ethyl 3-cyclo entyl-3-hydroxy-2-vinylpropanoate

Specifications

同義語

Cyclopentanecarbaldehyde, 0.1% hydroquinone as stabilizer | cyclopentanecaboxaldehyde | C3019 | Formylcyclopentane | Cyclopentanecarbaldehyde | EN300-57255 | Cyclopentanecarboxaldehyde (25ppm 1,4-Benzoquinone as stabiliser) | BBL100156 | Cyclopentanealdeh

仕様と純度

≥98%, contains 0.1% hydroquinone as stabilizer

保管条件

Store at 2-8°C,Argon charged

入荷

Wet ice

この製品は冷冷この冷このこの製品の運送が必要です。地上およびその他の経済サービスは利用できません。

純度

≥98%

名前と識別子

• パブケム・シド: 508814744
• パブケム・シド・ウル: https://pubchem.ncbi.nlm.nih.gov/substance/508814744
• カノニカル・スマイル: C1CCC(C1)C=O
• IUPAC Name: cyclopentanecarbaldehyde
• InChIKey: VELDYOPRLMJFIK-UHFFFAOYSA-N
• INCHI: 1S/C6H10O/c7-5-6-3-1-2-4-6/h5-6H,1-4H2
• 異性体SMILES: C1CCC(C1)C=O
• WGKドイツ: 3
• UN番号: 1989
• 分子量: 98.14
• Reaxy-Rn: 1560515
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1560515&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic oxygen compounds
    • 分類 Organic oxides

• Kingdom: Organic compounds
• Superclass: Organic oxygen compounds
• 分類: 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
• 説明: 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

作用メカニズム

化学的性質と物理的性質

• 溶解度: Soluble in water and ethanol
• 感度: Heat sensitive; Air sensitive
• 屈折率: 1.443
• 引火点（°F）: 82.4 °F
• 引火点（°C）: 28 °C
• 沸点（°C）: 140-141°C
• 分子量: 98.140 g/mol
• XLogP3: 1.300
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 1
• Exact Mass: 98.0732 Da
• Monoisotopic Mass: 98.0732 Da
• Topological Polar Surface Area: 17.100 Ų
• Heavy Atom Count: 7
• Formal Charge: 0
• Complexity: 62.600
• 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

参考文献

1. Jing Zhang, Xun Kuang, Linyu Zhu, Xintong Xiao, Zhongyue Zhou, Fei Qi.  (2024)  Sustainable production of cyclohexanones through hydrodeoxygenation of lignin-derived phenolics over PdFe/HZSM-5 catalysts.  FUEL,      [PMID:] [10.1016/j.fuel.2024.133863]

2. Yingxuan Zhao, Chenyang Shen, Qing Liu, Siyuan Zhao, Ruiyao Zhao, Xiangke Guo, Nianhua Xue, Luming Peng, Xuefeng Guo, Yan Zhu, Weiping Ding.  (2026)  Electrocatalytic oxidation or amidation of olefins by asymmetric electrolytes steering carbocation pathways.  GREEN CHEMISTRY,      [PMID:] [10.1039/D5GC07050C]