Diethy phthalate(DEP) - AR, ≥99.5% , CAS No.84-66-2

CAS: 84-66-2 Cat. No.: D108216 Formula: C₁₂H₁₄O₄ Peso molecolare: 222.24 Beilstein Registry Number: 1912500 Numero EC: 201-550-6

GRADE & PURITY AR, ≥99.5%

Synonyms

Diethyl phthalate, >=99.5% | Diethyl phthalate, 99.5% | DIETHYL PHTHALATE [VANDF] | NCGC00090974-01 | Phthalsaeurediaethylester | Phthalsaeurediaethylester [German] | bmse000846 | CCRIS 2675 | DIETHYL PHTHALATE [INCI] | NCGC00090974-06 | PHTHALIC ACID,DIE

Storage

Room temperature

Shipped In

Normal

Panoramica

Diethyl phthalate (DEP) is a phthalic anhydride ester (PAE) that is commonly used as a solvent in cosmetics and also as a plasticizer.

Application：

Diethyl phthalate can be used as a solvent for the antimony reduction of aluminum chloride-phosphorus trichloride-alkyl chloride complexes to form the corresponding alkylphosphonous dichlorides.
It can undergo condensation with o-phenylenediamine in the presence of sodium hydride to form dibenzo (b,f)(1,4)diazocine-6,11(5H, 12H)-dione.

Specifications

Sinonimi

Diethyl phthalate, >=99.5% | Diethyl phthalate, 99.5% | DIETHYL PHTHALATE [VANDF] | NCGC00090974-01 | Phthalsaeurediaethylester | Phthalsaeurediaethylester [German] | bmse000846 | CCRIS 2675 | DIETHYL PHTHALATE [INCI] | NCGC00090974-06 | PHTHALIC ACID,DIE

Specifiche e purezza

AR, ≥99.5%

Condizioni di conservazione di stoccaggio

Room temperature

Spedito in

Normal

Grado

AR

Purezza

≥99.5%

Nomi e identificatori

Pubchem Sid

508816693

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/508816693

Sorrisi canonici

CCOC(=O)C1=CC=CC=C1C(=O)OCC

IUPAC Name

diethyl benzene-1,2-dicarboxylate

InChIKey

FLKPEMZONWLCSK-UHFFFAOYSA-N

INCHI

1S/C12H14O4/c1-3-15-11(13)9-7-5-6-8-10(9)12(14)16-4-2/h5-8H,3-4H2,1-2H3

Isomeri SMILES

CCOC(=O)C1=CC=CC=C1C(=O)OCC

WGK Germania

2

RTECS

TI1050000

Peso molecolare

222.24

Beilstein

1912500

Reaxy-Rn

1912500

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1912500&ln=

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Classe: Benzene and substituted derivatives
• Subclass: Benzoic acids and derivatives
• Intermediate Tree Nodes: Not available
• Direct Parent: Benzoic acid esters
• Alternative Parents: Benzoyl derivatives Dicarboxylic acids and derivatives Carboxylic acid esters Organooxygen compounds Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Benzoate ester - Benzoyl - Dicarboxylic acid or derivatives - Carboxylic acid ester - Carboxylic acid derivative - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Aromatic homomonocyclic compound
• Descrizione: This compound belongs to the class of organic compounds known as benzoic acid esters. These are ester derivatives of benzoic acid.
• External Descriptors: Phthalates

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

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Meccanismi d'azione

Proprietà chimiche e fisiche

• Solubilità: Solubility in water: Practically Insoluble; Degree of Solubility in water: 1,000 mg/l 25 °C; Soluble in Benzene,Alcohol,Acetone,Ether
• Sensibilità: Moisture sensitive.
• Indice di rifrazione: 1.502
• Punto di infiammabilità (°F): 312.8 °F
• Punto di infiammabilità (°C): 156 °C
• Punto di ebollizione (°C): 298-299°C
• Punto di fusione (°C): -3°C
• Peso molecolare: 222.240 g/mol
• XLogP3: 2.500
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 6
• Exact Mass: 222.089 Da
• Monoisotopic Mass: 222.089 Da
• Topological Polar Surface Area: 52.600 Ų
• Heavy Atom Count: 16
• Formal Charge: 0
• Complexity: 223.000
• 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