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

COA

Grade & Purity:

≥97%

Cas Number: 6607-66-5
Molecular Weight: 148.2
MDL number: MFCD00008478
PubChem CID: 81084

In stock

Item Number

T469511

Grouped product items
SKU	Size	Availability	Price	Qty
T469511-25g	25g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$534.90

Basic Description

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
Specifications & Purity	≥97%
Product Description	Description 1,3,3-Trimethoxybutane may be used in chemical synthesis studies.

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organic oxygen compounds
  - Class Organooxygen compounds
    - Subclass Ethers
      - Level5 Acetals
        Level6 Ketals

Kingdom	Organic compounds
Superclass	Organic oxygen compounds
Class	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
Description	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
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

Names and Identifiers

IUPAC Name	1,3,3-trimethoxybutane
INCHI	InChI=1S/C7H16O3/c1-7(9-3,10-4)5-6-8-2/h5-6H2,1-4H3
InChIKey	DIQSNTFKLAYVOT-UHFFFAOYSA-N
Smiles	CC(CCOC)(OC)OC
Isomeric SMILES	CC(CCOC)(OC)OC
WGK Germany	3
PubChem CID	81084
Molecular Weight	148.2

Certificates（CoA,COO,BSE/TSE and Analysis Chart)

C of A & Other Certificates(BSE/TSE, COO):

Analytical Chart:

Chemical and Physical Properties

Flash Point(°F)	114.8 °F
Flash Point(°C)	46 °C
Molecular Weight	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 Å²
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

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