Aldeide di Myrac - ≥97%, contenente diverse quantità di 3-(4-Metil-3-Pentenil)Cicloes-3-Ene-1-Carbaldeide , CAS No.37677-14-8

CAS: 37677-14-8 Cat. No.: M189130 Formula: C₁₃H₂₀O Peso molecolare: 192.3 Numero EC: 253-617-4

GRADE & PURITY ≥97%, Containing different amounts of 3-(4-Methyl-3-Pentenyl)Cyclohex-3-Ene-1-Carbaldehyde

Synonyms

MQBIZQLCHSZBOI-UHFFFAOYSA-N | W-106522 | 3,5-Bis(beta-D-glucopyranosyloxy)-7-hydroxy-2-(4-hydroxy-3,5-dimethoxyphenyl)-1-benzopyrylium chloride | Myrac aldehyde | 4-(4-Methyl-3-pentenyl)-3-cyclohexene-1-carboxaldehyde | Isohexenyl cyclohexenyl carboxaldeh

Storage

Temperatura ambiente

Shipped In

Normale

Specifications

Sinonimi

MQBIZQLCHSZBOI-UHFFFAOYSA-N | W-106522 | 3,5-Bis(beta-D-glucopyranosyloxy)-7-hydroxy-2-(4-hydroxy-3,5-dimethoxyphenyl)-1-benzopyrylium chloride | Myrac aldehyde | 4-(4-Methyl-3-pentenyl)-3-cyclohexene-1-carboxaldehyde | Isohexenyl cyclohexenyl carboxaldeh

Specifiche e purezza

≥97%, contenente diverse quantità di 3-(4-Metil-3-Pentenil)Cicloes-3-Ene-1-Carbaldeide

Condizioni di conservazione di stoccaggio

Temperatura ambiente

Spedito in

Normale

Purezza

≥97%

Nomi e identificatori

• Pubchem Sid: 488186766
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488186766
• Sorrisi canonici: CC(=CCCC1=CCC(CC1)C=O)C
• IUPAC Name: 4-(4-methylpent-3-enyl)cyclohex-3-ene-1-carbaldehyde
• InChIKey: MQBIZQLCHSZBOI-UHFFFAOYSA-N
• INCHI: 1S/C13H20O/c1-11(2)4-3-5-12-6-8-13(10-14)9-7-12/h4,6,10,13H,3,5,7-9H2,1-2H3
• Isomeri SMILES: CC(=CCCC1=CCC(CC1)C=O)C
• Peso molecolare: 192.3
• Reaxy-Rn: 1936411
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1936411&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Lipids and lipid-like molecules
    • Classe Prenol lipids
      • Subclass Monoterpenoids

• Kingdom: Organic compounds
• Superclass: Lipids and lipid-like molecules
• Classe: Prenol lipids
• Subclass: Monoterpenoids
• Intermediate Tree Nodes: Not available
• Direct Parent: Monocyclic monoterpenoids
• Alternative Parents: Organic oxides Hydrocarbon derivatives Aldehydes
• Molecular Framework: Aliphatic homomonocyclic compounds
• Substituents: Monocyclic monoterpenoid - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Aldehyde - Aliphatic homomonocyclic compound
• Descrizione: This compound belongs to the class of organic compounds known as monocyclic monoterpenoids. These are monoterpenoids containing 1 ring in the isoprene chain.
• 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

Proprietà chimiche e fisiche

• Indice di rifrazione: 1.4912
• Peso molecolare: 192.300 g/mol
• XLogP3: 3.000
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 4
• Exact Mass: 192.151 Da
• Monoisotopic Mass: 192.151 Da
• Topological Polar Surface Area: 17.100 Ų
• Heavy Atom Count: 14
• Formal Charge: 0
• Complexity: 244.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 1
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1

Domande frequenti

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 37677-14-8, the molecular formula is C13H20O, and the molecular weight is 192.3 g/mol. InChIKey MQBIZQLCHSZBOI-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.