tert-Butyl methyl ether（MTBE） - anhydrous, ≥99.8% , CAS No.1634-04-4

CAS: 1634-04-4 Cat. No.: B119671 Fórmula: C₅H₁₂O Peso molecular: 88.15 Beilstein Registry Number: 1730942 Número EC: 216-653-1

GRADE & PURITY Anhydrous Grade, ≥99.8%

Synonyms

MTBE | HSDB 5847 | metyl tert-butyl ether | tert. butyl-methylether | tert. butyl-methyl-ether | tert.-butyl methylether | CHEBI:27642 | tertbutylmethylether | tert-butylmethylether | tert-butyl-methylether | tert-butyl-methyl-ether | 2-Methoxy-2-methylpr

Storage

Room temperature

Shipped In

FedEx DG Service

Specifications

Sinónimos

MTBE | HSDB 5847 | metyl tert-butyl ether | tert. butyl-methylether | tert. butyl-methyl-ether | tert.-butyl methylether | CHEBI:27642 | tertbutylmethylether | tert-butylmethylether | tert-butyl-methylether | tert-butyl-methyl-ether | 2-Methoxy-2-methylpr

Especificaciones y pureza

anhydrous, ≥99.8%

Condiciones de almacenamiento de almacenamiento

Room temperature

Enviado en

FedEx DG Service

Grado

Anhydrous Grade

Pureza

≥99.8%

Nombres e identificadores

Pubchem Sid

504752661

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/504752661

Sonrisas canónicas

CC(C)(C)OC

IUPAC Name

2-methoxy-2-methylpropane

InChIKey

BZLVMXJERCGZMT-UHFFFAOYSA-N

INCHI

1S/C5H12O/c1-5(2,3)6-4/h1-4H3

Isómeros SMILES

CC(C)(C)OC

WGK Alemania

1

RTECS

KN5250000

Número ONU

2398

Grupo de embalaje

II

Peso molecular

88.15

Beilstein

1730942

Reaxy-Rn

1730942

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1730942&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic oxygen compounds
    • Clase Organooxygen compounds
      • Subclass Ethers

• Kingdom: Organic compounds
• Superclass: Organic oxygen compounds
• Clase: Organooxygen compounds
• Subclass: Ethers
• Intermediate Tree Nodes: Not available
• Direct Parent: Dialkyl ethers
• Alternative Parents: Hydrocarbon derivatives
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Dialkyl ether - Hydrocarbon derivative - Aliphatic acyclic compound
• Descripción: This compound belongs to the class of organic compounds known as dialkyl ethers. These are organic compounds containing the dialkyl ether functional group, with the formula ROR', where R and R' are alkyl groups.
• External Descriptors: ether

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

Mecanismos de acción

Propiedades químicas y físicas

• Índice de refracción: 1.3689
• Punto de inflamación (°F): -18.4℉
• Punto de inflamación (°C): -28℃
• Punto de ebullición (°C): 55.2°C
• Punto de fusión (°C): -109°C
• Peso molecular: 88.150 g/mol
• XLogP3: 0.900
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 1
• Exact Mass: 88.0888 Da
• Monoisotopic Mass: 88.0888 Da
• Topological Polar Surface Area: 9.200 Ų
• Heavy Atom Count: 6
• Formal Charge: 0
• Complexity: 33.700
• 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