2-Ethoxy-1-naphthoyl chloride - ≥97% , CAS No.55150-29-3

CAS: 55150-29-3 Cat. No.: E300335 Fórmula: C₁₃H₁₁ClO₂ Peso molecular: 234.68 Número CE: 259-502-5

GRAU & PUREZA ≥97%

Synonyms

W-105584 | DTXSID4069002 | MFCD00046426 | ZRVFFIXOCFUHDA-UHFFFAOYSA-N | AKOS005207289 | 1-Naphthalenecarbonyl chloride, 2-ethoxy- | EINECS 259-502-5 | BCP19159 | 2-ethoxy naphthoyl chloride | 2-Ethoxy-1-naphthoyl Chloride | FT-0612197 | 2-Ethoxy-naphthale

Storage

Store at 2-8°C

Shipped In

Wet ice

Especificações

Sinónimos

W-105584 | DTXSID4069002 | MFCD00046426 | ZRVFFIXOCFUHDA-UHFFFAOYSA-N | AKOS005207289 | 1-Naphthalenecarbonyl chloride, 2-ethoxy- | EINECS 259-502-5 | BCP19159 | 2-ethoxy naphthoyl chloride | 2-Ethoxy-1-naphthoyl Chloride | FT-0612197 | 2-Ethoxy-naphthale

Especificações e pureza

≥97%

Condições de armazenamento de armazenamento

Store at 2-8°C

Enviado em

Wet ice

Este produto requer transporte de cadeia fria. Serviços terrestres e outros serviços econômicos não estão disponíveis.

Pureza

≥97%

Nomes e identificadores

Pubchem Sid

528756262

Sorrisos canónicos

CCOC1=C(C2=CC=CC=C2C=C1)C(=O)Cl

IUPAC Name

2-ethoxynaphthalene-1-carbonyl chloride

InChIKey

ZRVFFIXOCFUHDA-UHFFFAOYSA-N

INCHI

1S/C13H11ClO2/c1-2-16-11-8-7-9-5-3-4-6-10(9)12(11)13(14)15/h3-8H,2H2,1H3

SMILES isoméricas

CCOC1=C(C2=CC=CC=C2C=C1)C(=O)Cl

Peso molecular

234.68

Reaxy-Rn

2844104

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2844104&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Classe Naphthalenes
      • Subclass Naphthalenecarboxylic acids and derivatives

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Classe: Naphthalenes
• Subclass: Naphthalenecarboxylic acids and derivatives
• Intermediate Tree Nodes: Not available
• Direct Parent: Naphthalenecarboxylic acids and derivatives
• Alternative Parents: Alkyl aryl ethers Acyl chlorides Organochlorides Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aromatic homopolycyclic compounds
• Substituents: 1-naphthalenecarboxylic acid or derivatives - Alkyl aryl ether - Ether - Acyl halide - Acyl chloride - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organochloride - Organohalogen compound - Aromatic homopolycyclic compound
• Descrição: This compound belongs to the class of organic compounds known as naphthalenecarboxylic acids and derivatives. These are compounds containing a naphthalene moiety, which bears a carboxylic acid group or a derivative at one or more positions. Naphthalene is a bicyclic compound that is made up of two fused benzene ring.
• 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

Propriedades químicas e físicas

• Sensibilidade: Moisture sensitive.
• Ponto de fusão (°C): 76-80°C
• Peso molecular: 234.680 g/mol
• XLogP3: 4.000
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 234.045 Da
• Monoisotopic Mass: 234.045 Da
• Topological Polar Surface Area: 26.300 Ų
• Heavy Atom Count: 16
• Formal Charge: 0
• Complexity: 254.000
• 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