Lactato de etilo - ≥98% , CAS No.97-64-3

CAS: 97-64-3 Cat. No.: E108230 Fórmula: C₅H₁₀O₃ Peso molecular: 118.13 Beilstein Registry Number: 3(4)643 Número CE: 202-598-0

GRADE & PURITY ≥98%

Synonyms

2-Hydroxypropanoic acid ethyl ester | A9137 | CAS-97-64-3 | UNII-F3P750VW8I | EINECS 202-598-0 | FEMA No. 2440 | Lactic acid, ethyl ester | Lactate d'ethyle [French] | AI3-00395 | Ethyl 2-hydroxypropanoate # | ethyl d-lactate | Ethyl lactate (natural) | T

Storage

Dessecado

Shipped In

FedEx DG Service

Specifications

Sinónimos

2-Hydroxypropanoic acid ethyl ester | A9137 | CAS-97-64-3 | UNII-F3P750VW8I | EINECS 202-598-0 | FEMA No. 2440 | Lactic acid, ethyl ester | Lactate d'ethyle [French] | AI3-00395 | Ethyl 2-hydroxypropanoate # | ethyl d-lactate | Ethyl lactate (natural) | T

Especificações e pureza

≥98%

Condições de armazenamento de armazenamento

Dessecado

Enviado em

FedEx DG Service

Pureza

≥98%

Nomes e identificadores

Pubchem Sid

488180388

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/488180388

Sorrisos canónicos

CCOC(=O)C(C)O

IUPAC Name

ethyl 2-hydroxypropanoate

InChIKey

LZCLXQDLBQLTDK-UHFFFAOYSA-N

INCHI

1S/C5H10O3/c1-3-8-5(7)4(2)6/h4,6H,3H2,1-2H3

SMILES isoméricas

CCOC(=O)C(C)O

WGK Alemanha

1

RTECS

OD5075000

Número UN

1192

Grupo de embalagem

III

Peso molecular

118.13

Beilstein

3(4)643

Reaxy-Rn

1209448

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1209448&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic acids and derivatives
    • Classe Carboxylic acids and derivatives
      • Subclass Carboxylic acid derivatives

• Kingdom: Organic compounds
• Superclass: Organic acids and derivatives
• Classe: Carboxylic acids and derivatives
• Subclass: Carboxylic acid derivatives
• Intermediate Tree Nodes: Not available
• Direct Parent: Carboxylic acid esters
• Alternative Parents: Secondary alcohols Monocarboxylic acids and derivatives Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Secondary alcohol - Carboxylic acid ester - Monocarboxylic acid or derivatives - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Alcohol - Aliphatic acyclic compound
• Descrição: This compound belongs to the class of organic compounds known as carboxylic acid esters. These are carboxylic acid derivatives in which the carbon atom from the carbonyl group is attached to an alkyl or an aryl moiety through an oxygen atom (forming an ester group).
• External Descriptors: ethyl ester - secondary alcohol - lactate ester

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

• Solubilidade: Solubility in water: Completely miscible; Miscible with Chloroform,Alcohol,Ether
• Índice de refração: 1.4125
• Ponto de ebulição (°C): 154°C
• Ponto de fusão (°C): -25°C
• Peso molecular: 118.130 g/mol
• XLogP3: 0.200
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 118.063 Da
• Monoisotopic Mass: 118.063 Da
• Topological Polar Surface Area: 46.500 Ų
• Heavy Atom Count: 8
• Formal Charge: 0
• Complexity: 79.700
• 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