Butyl methacrylate - Standard for GC, ≥99.5%(GC), Containing MEHQ stabilizer , CAS No.97-88-1

CAS: 97-88-1 Cat. No.: B110904 Fórmula: C₈H₁₄O₂ Peso molecular: 142.2 Beilstein Registry Number: 773960 Número CE: 202-615-1

GRAU & PUREZA Standard for GC, ≥99.5%(GC), Containing MEHQ stabilizer

Synonyms

Butil metacrilato [Italian] | Butyl ester of methacrylic acid | EC 202-615-1 | nBMA | Butylester kyseliny methakrylove | DTXSID4024696 | NSC20956 | 2-Methyl-butylacrylat | 2-Propenoic acid, 2-methyl-, butyl ester | DTXCID704696 | n-butylmethacrylate | STL

Storage

Room temperature

Shipped In

FedEx DG Service

Especificações

Sinónimos

Butil metacrilato [Italian] | Butyl ester of methacrylic acid | EC 202-615-1 | nBMA | Butylester kyseliny methakrylove | DTXSID4024696 | NSC20956 | 2-Methyl-butylacrylat | 2-Propenoic acid, 2-methyl-, butyl ester | DTXCID704696 | n-butylmethacrylate | STL

Especificações e pureza

Standard for GC, ≥99.5%(GC), Containing MEHQ stabilizer

Condições de armazenamento de armazenamento

Room temperature

Enviado em

FedEx DG Service

Grau

Standard for GC

Pureza

≥99.5%(GC)

Nomes e identificadores

Pubchem Sid

508814849

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/508814849

Sorrisos canónicos

CCCCOC(=O)C(=C)C

IUPAC Name

butyl 2-methylprop-2-enoate

InChIKey

SOGAXMICEFXMKE-UHFFFAOYSA-N

INCHI

1S/C8H14O2/c1-4-5-6-10-8(9)7(2)3/h2,4-6H2,1,3H3

SMILES isoméricas

CCCCOC(=O)C(=C)C

WGK Alemanha

1

RTECS

OZ3675000

Número UN

2227

Grupo de embalagem

III

Peso molecular

142.2

Beilstein

773960

Reaxy-Rn

773960

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=773960&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic acids and derivatives
    • Classe Carboxylic acids and derivatives
      • Subclass Carboxylic acid derivatives
        • Level5 Carboxylic acid esters
          • Level6 Alpha,beta-unsaturated carboxylic esters
            • Level7 Enoate esters

• Kingdom: Organic compounds
• Superclass: Organic acids and derivatives
• Classe: Carboxylic acids and derivatives
• Subclass: Carboxylic acid derivatives
• Intermediate Tree Nodes: Carboxylic acid esters - Alpha,beta-unsaturated carboxylic esters
• Direct Parent: Enoate esters
• Alternative Parents: Monocarboxylic acids and derivatives Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Enoate ester - Monocarboxylic acid or derivatives - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Aliphatic acyclic compound
• Descrição: This compound belongs to the class of organic compounds known as enoate esters. These are an alpha,beta-unsaturated carboxylic ester of general formula R1C(R2)=C(R3)C(=O)OR4 (R4= organyl compound) in which the ester C=O function is conjugated to a C=C double bond at the alpha,beta position.
• 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

• Índice de refração: 1.4229
• Ponto de inflamação (°F): 129.2 °F
• Ponto de inflamação (°C): 41℃
• Ponto de ebulição (°C): 160-163°C
• Ponto de fusão (°C): -75°C
• Peso molecular: 142.200 g/mol
• XLogP3: 2.900
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 5
• Exact Mass: 142.099 Da
• Monoisotopic Mass: 142.099 Da
• Topological Polar Surface Area: 26.300 Ų
• Heavy Atom Count: 10
• Formal Charge: 0
• Complexity: 127.000
• 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