1,3,3-Trimethoxybutane - ≥97% , CAS No.6607-66-5

CAS: 6607-66-5 Cat. No.: T469511 Formula: CH₃C(OCH₃)₂CH₂CH₂OCH₃ Peso molecolare: 148.2 Numero EC: 229-555-9 PubChem CID: 81084

GRADE & PURITY ≥97%

Synonyms

SCHEMBL5892341 | EINECS 229-555-9 | Benzeneethanamine, 2-methoxy-a-methyl- | LSR464P76K | DTXSID30216273 | FT-0754758 | AKOS009156873 | 1,3,3-Trimethoxybutane | 1,3,3-trimethoxy butane | 1,3,3-Trimethoxybutane, 97% | Butane, 1,3,3-trimethoxy- | 4-Methoxyb

Storage

Room temperature

Panoramica

Description

1,3,3-Trimethoxybutane may be used in chemical synthesis studies.

Specifications

Sinonimi

SCHEMBL5892341 | EINECS 229-555-9 | Benzeneethanamine, 2-methoxy-a-methyl- | LSR464P76K | DTXSID30216273 | FT-0754758 | AKOS009156873 | 1,3,3-Trimethoxybutane | 1,3,3-trimethoxy butane | 1,3,3-Trimethoxybutane, 97% | Butane, 1,3,3-trimethoxy- | 4-Methoxyb

Specifiche e purezza

≥97%

Condizioni di conservazione di stoccaggio

Room temperature

Purezza

≥97%

Nomi e identificatori

Sorrisi canonici

CC(CCOC)(OC)OC

IUPAC Name

1,3,3-trimethoxybutane

InChIKey

DIQSNTFKLAYVOT-UHFFFAOYSA-N

INCHI

1S/C7H16O3/c1-7(9-3,10-4)5-6-8-2/h5-6H2,1-4H3

Isomeri SMILES

CC(CCOC)(OC)OC

WGK Germania

3

PubChem CID

81084

Peso molecolare

148.2

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic oxygen compounds
    • Classe Organooxygen compounds
      • Subclass Ethers
        • Level5 Acetals
          • Level6 Ketals

• Kingdom: Organic compounds
• Superclass: Organic oxygen compounds
• Classe: Organooxygen compounds
• Subclass: Ethers
• Intermediate Tree Nodes: Acetals
• Direct Parent: Ketals
• Alternative Parents: Dialkyl ethers Hydrocarbon derivatives
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Ketal - Dialkyl ether - Hydrocarbon derivative - Aliphatic acyclic compound
• Descrizione: This compound belongs to the class of organic compounds known as ketals. These are acetals derived from ketones by replacement of the oxo group by two hydrocarbyloxy groups R2C(OR)2 ( R not Hydrogen ). This term, once abandoned, has been reinstated as a subclass of acetals.
• 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

Proprietà chimiche e fisiche

• Punto di infiammabilità (°F): 114.8 °F
• Punto di infiammabilità (°C): 46 °C
• Peso molecolare: 148.200 g/mol
• XLogP3: 0.500
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 5
• Exact Mass: 148.11 Da
• Monoisotopic Mass: 148.11 Da
• Topological Polar Surface Area: 27.700 Ų
• Heavy Atom Count: 10
• Formal Charge: 0
• Complexity: 78.900
• 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

Domande frequenti

What is the purity of this product?

This product is supplied at ≥97% purity (chemical assay). Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store at room temperature.

What are the CAS number, molecular formula and molecular weight?

The CAS Number is 6607-66-5, the molecular formula is CH3C(OCH3)2CH2CH2OCH3, and the molecular weight is 148.2 g/mol. InChIKey DIQSNTFKLAYVOT-UHFFFAOYSA-N.

What documentation is provided?

Available product documentation, including Certificates of Analysis (COA), Safety Data Sheets (SDS), and specification sheets, is shown in the product document area. Document availability and access follow the current site policy.