4-Ethylbenzaldehyde - Moligand™, ≥97% , CAS No.4748-78-1

CAS: 4748-78-1 Cat. No.: E102795 Formula: C₂H₅C₆H₄CHO Peso molecolare: 134.18 Beilstein Registry Number: 7307 Numero EC: 225-268-8

QUALITÀ & PUREZZA Moligand™, ≥97%

Synonyms

4-ethyl benzaldehyde|p-Ethylbenzaldehyde|p-ethyl-benzaldehyde|Benzaldehyde, P-ethyl-|Benzaldehyde, 4-ethyl-|4-ETHYLBENZALDEHYDE|4-EthYl-Benzaldehyde|4-ETHYLBENZALDEHYDE [FHFI]|Ethyl-benzaldehyde|Ethyl benzaldehyde|p-Ethylbenzaldehyde, d|BENZALDEHYDE,4-ETHYL|Ethylbenzaldehyde, p-

Storage

Store at 2-8°C,Argon charged

Shipped In

Wet ice

Panoramica

4-Ethylbenzaldehyde is an aldehyde type organic compound with an almond-like odor. 4-Ethylbenzaldehyde is naturally present in various foods such as grilled meat, black tea, peanuts, etc. 4-Ethylbenzaldehyde has significant effects in controlling plant parasitic nematodes. 4-Ethylbenzaldehyde has genotoxicity and potential for liver damage in zebrafish models.

Specifiche

Sinonimi

4-ethyl benzaldehyde | p-Ethylbenzaldehyde | p-ethyl-benzaldehyde | Benzaldehyde, P-ethyl- | Benzaldehyde, 4-ethyl- | 4-ETHYLBENZALDEHYDE | 4-EthYl-Benzaldehyde | 4-ETHYLBENZALDEHYDE [FHFI] | Ethyl-benzaldehyde | Ethyl benzaldehyde | p-Ethylbenzaldehyde, d | BENZALDEHYDE,4-ETHYL | Ethylbenzaldehyde, p-

Specifiche e purezza

Moligand™, ≥97%

Condizioni di conservazione di stoccaggio

Store at 2-8°C,Argon charged

Spedito in

Wet ice

Questo prodotto richiede spedizione a catena fredda. I servizi di terra e altri servizi economici non sono disponibili.

Grado

Moligand™

Purezza

≥97%

Nomi e identificatori

Pubchem Sid

488182649

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/488182649

Sorrisi canonici

CCC1=CC=C(C=C1)C=O

IUPAC Name

4-ethylbenzaldehyde

InChIKey

QNGNSVIICDLXHT-UHFFFAOYSA-N

INCHI

1S/C9H10O/c1-2-8-3-5-9(7-10)6-4-8/h3-7H,2H2,1H3

Isomeri SMILES

CCC1=CC=C(C=C1)C=O

WGK Germania

3

Peso molecolare

134.18

Beilstein

7307

Reaxy-Rn

636027

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=636027&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Classe Benzene and substituted derivatives
      • Subclass Benzoyl derivatives

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Classe: Benzene and substituted derivatives
• Subclass: Benzoyl derivatives
• Intermediate Tree Nodes: Not available
• Direct Parent: Benzoyl derivatives
• Alternative Parents: Benzaldehydes Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Benzoyl - Benzaldehyde - Aryl-aldehyde - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Aldehyde - Aromatic homomonocyclic compound
• Descrizione: This compound belongs to the class of organic compounds known as benzoyl derivatives. These are organic compounds containing an acyl moiety of benzoic acid with the formula (C6H5CO-).
• 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

Meccanismi d'azione

Proprietà chimiche e fisiche

• Sensibilità: Air sensitive
• Indice di rifrazione: 1.539
• Punto di infiammabilità (°F): 197.6 °F
• Punto di infiammabilità (°C): 92°C
• Punto di ebollizione (°C): 221°C
• Peso molecolare: 134.170 g/mol
• XLogP3: 2.400
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 2
• Exact Mass: 134.073 Da
• Monoisotopic Mass: 134.073 Da
• Topological Polar Surface Area: 17.100 Ų
• Heavy Atom Count: 10
• Formal Charge: 0
• Complexity: 101.000
• 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