(9Z,12E)-Tetradecadien-1-yl Acetate - ≥90% , CAS No.31654-77-0

CAS: 31654-77-0 Cat. No.: C353734 Peso molecular: 252.39 Número EC: 250-753-6

GRADE & PURITY ≥90%

Synonyms

(Z)-9-(E)-12-Tetradecadien-1-ol acetate | 7Q008ABC8A | Z9E12-14Ac | 9,12-Tetradecadien-1-yl, acetate, (E,Z)- | Tox21_302010 | EINECS 221-422-3 | HY-128701 | Q27268698 | Pherodin SL | NCGC00255494-01 | AKOS040744162 | UNII-7Q008ABC8A | 9,12-Tetradecadien-1

Storage

Protected from light,Store at -20°C

Shipped In

Ice chest + Ice pads

Descripción general

cis-9,trans-12-Tetradecadienyl acetate is a pheromone for Anagasta kuhniella, Cadra elutella, Cadra cautella, Cadra figulilella, Plodia interpunctella, Spodoptera exigua, Spodoptera exempta and Spodoptera litura.

Specifications

Sinónimos

(Z)-9-(E)-12-Tetradecadien-1-ol acetate | 7Q008ABC8A | Z9E12-14Ac | 9, 12-Tetradecadien-1-yl, acetate, (E, Z)- | Tox21_302010 | EINECS 221-422-3 | HY-128701 | Q27268698 | Pherodin SL | NCGC00255494-01 | AKOS040744162 | UNII-7Q008ABC8A | 9, 12-Tetradecadien-1

Especificaciones y pureza

≥90%

Condiciones de almacenamiento de almacenamiento

Protected from light, Store at -20°C

Enviado en

Ice chest + Ice pads

Este producto requiere envío en cadena de frío. Los servicios terrestres y otros servicios económicos no están disponibles.

Pureza

≥90%

Nombres e identificadores

• Pubchem Sid: 504764169
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504764169
• Sonrisas canónicas: CC=CCC=CCCCCCCCCOC(=O)C
• IUPAC Name: [(9E,12Z)-tetradeca-9,12-dienyl] acetate
• InChIKey: ZZGJZGSVLNSDPG-WWVFNRLHSA-N
• INCHI: 1S/C16H28O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-18-16(2)17/h3-4,6-7H,5,8-15H2,1-2H3/b4-3-,7-6+
• Isómeros SMILES: C/C=C\C/C=C/CCCCCCCCOC(=O)C
• Peso molecular: 252.39
• Reaxy-Rn: 5377912
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=5377912&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Lipids and lipid-like molecules
    • Clase Fatty Acyls
      • Subclass Fatty alcohol esters

• Kingdom: Organic compounds
• Superclass: Lipids and lipid-like molecules
• Clase: Fatty Acyls
• Subclass: Fatty alcohol esters
• Intermediate Tree Nodes: Not available
• Direct Parent: Fatty alcohol esters
• Alternative Parents: Carboxylic acid esters Monocarboxylic acids and derivatives Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Fatty alcohol ester - Carboxylic acid ester - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Aliphatic acyclic compound
• Descripción: This compound belongs to the class of organic compounds known as fatty alcohol esters. These are ester derivatives of a fatty alcohol.
• 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

Propiedades químicas y físicas

• Solubilidad: Benzene (Slightly), Chloroform (Slightly), Methanol (Slightly)
• Sensibilidad: light sensitive
• Peso molecular: 252.390 g/mol
• XLogP3: 5.300
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 12
• Exact Mass: 252.209 Da
• Monoisotopic Mass: 252.209 Da
• Topological Polar Surface Area: 26.300 Ų
• Heavy Atom Count: 18
• Formal Charge: 0
• Complexity: 241.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 2
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 2
• Covalently-Bonded Unit Count: 1