Cyclopropanecarboxaldehyde - ≥98% , CAS No.1489-69-6

CAS: 1489-69-6 Cat. No.: C106978 Molecular Weight: 70.09 Beilstein Registry Number: 7(4)4 EC Number: 620-777-5

GRADE & PURITY ≥98%

Synonyms

STR05750 | 1-(Formyl)cyclopropane | CHEBI:143341 | cyclopropanecarboaldehyde | F0001-2585 | EN300-235714 | cyclopropancarboxaldehyde | cyclopropanal | PS-3941 | BBL034662 | BCP26792 | cyclopropane carboaldehyde | CAS-1489-69-6 | EN300-43935 | AM90182 | cy

Storage

Store at 2-8°C,Argon charged

Shipped In

Wet ice

Specifications

Synonyms

STR05750 | 1-(Formyl)cyclopropane | CHEBI:143341 | cyclopropanecarboaldehyde | F0001-2585 | EN300-235714 | cyclopropancarboxaldehyde | cyclopropanal | PS-3941 | BBL034662 | BCP26792 | cyclopropane carboaldehyde | CAS-1489-69-6 | EN300-43935 | AM90182 | cy

Specifications & Purity

≥98%

Storage

Store at 2-8°C, Argon charged

Shipped In

Wet ice

This product requires cold chain shipping. Ground and other economy services are not available.

Purity

≥98%

Names and Identifiers

• Pubchem Sid: 508814706
• Canonical Smiles: C1CC1C=O
• IUPAC Name: cyclopropanecarbaldehyde
• InChIKey: JMYVMOUINOAAPA-UHFFFAOYSA-N
• INCHI: 1S/C4H6O/c5-3-4-1-2-4/h3-4H,1-2H2
• Isomeric SMILES: C1CC1C=O
• WGK Germany: 3
• RTECS: GZ1005000
• UN Number: 2924
• Molecular Weight: 70.09
• Beilstein: 7(4)4
• Reaxy-Rn: 906781
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=906781&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic oxygen compounds
    • Class Organic oxides

• Kingdom: Organic compounds
• Superclass: Organic oxygen compounds
• Class: 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
• Description: 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

Chemical and Physical Properties

• Solubility: Soluble in water.
• Sensitivity: air sensitive ;heat sensitive
• Refractive Index: 1.4285-1.4305
• Flash Point(°F): 44.6 °F
• Flash Point(°C): 7℃
• Boil Point(°C): 98-101°C
• Molecular Weight: 70.090 g/mol
• XLogP3: 0.200
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 1
• Exact Mass: 70.0419 Da
• Monoisotopic Mass: 70.0419 Da
• Topological Polar Surface Area: 17.100 Ų
• Heavy Atom Count: 5
• Formal Charge: 0
• Complexity: 45.600
• 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

References

1. De-qiang Li, Maryamgul Tohti, Yong-sheng Fu, Yue Zhang, Zi-wei Xiong, Jun Li, Yan-Feng Guo.  (2024)  Aldehyde group pendant-grafted pectin-based injectable hydrogel.  INTERNATIONAL JOURNAL OF BIOLOGICAL MACROMOLECULES,      [PMID:38432279] [10.1016/j.ijbiomac.2024.130453]