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Trimethyl Orthoisobutyrate - 98%, high purity , CAS No.52698-46-1

COA

Grade & Purity:

≥98%

Cas Number: 52698-46-1
Molecular Weight: 148.2
PubChem CID: 40495
PubChem SID: 504753600

In stock

Item Number

T119208

Grouped product items
SKU	Size	Availability	Price
T119208-1g	1g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$11.90
T119208-5g	5g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$45.90
T119208-25g	25g	3	$179.90
T119208-100g	100g	3	$646.90
T119208-500g	500g	2	$2,908.90

View related series

Carbonyl compound (2335) carboxylic acid (2098)

Basic Description

Synonyms	1,1,1-trimethoxyisobutane \| AKOS011075596 \| 1,1,1-TRIMETHOXY-2-METHYLPROPANE \| 1,1,1-trimethoxy-2-methyl-propane \| MFCD08276428 \| T2208 \| E32PTH6Z4R \| Orthoisobutyric Acid Trimethyl Ester \| A829208 \| FT-0640096 \| EC 678-536-5 \| CS-0173471 \| TRIMETHYLORTHO
Specifications & Purity	≥98%
Storage Temp	Argon charged
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organic oxygen compounds
  - Class Organooxygen compounds
    - Subclass Ortho esters

Kingdom	Organic compounds
Superclass	Organic oxygen compounds
Class	Organooxygen compounds
Subclass	Ortho esters
Intermediate Tree Nodes	Not available
Direct Parent	Ortho esters
Alternative Parents	Carboxylic acid orthoesters Hydrocarbon derivatives
Molecular Framework	Aliphatic acyclic compounds
Substituents	Ortho ester - Carboxylic acid orthoester - Orthocarboxylic acid derivative - Hydrocarbon derivative - Aliphatic acyclic compound
Description	This compound belongs to the class of organic compounds known as ortho esters. These are compounds having the general structure RC(OR')3 ( R' not H), or the structure C(OR')4 ( R' not H).
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

Pubchem Sid	504753600
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/504753600
IUPAC Name	1,1,1-trimethoxy-2-methylpropane
INCHI	InChI=1S/C7H16O3/c1-6(2)7(8-3,9-4)10-5/h6H,1-5H3
InChIKey	BGLARIMANCDMQX-UHFFFAOYSA-N
Smiles	CC(C)C(OC)(OC)OC
Isomeric SMILES	CC(C)C(OC)(OC)OC
PubChem CID	40495
UN Number	3272
Molecular Weight	148.2
Reaxy-Rn	1737300

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

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

Analytical Chart:

Find and download the COA for your product by matching the lot number on the packaging.

6 results found

Lot Number	Certificate Type	Date	Item
D2502390	Certificate of Analysis	Jun 26, 2024	T119208
D2502391	Certificate of Analysis	Jun 26, 2024	T119208
I1401032	Certificate of Analysis	Jun 20, 2022	T119208
E2231483	Certificate of Analysis	Mar 23, 2022	T119208
E2231202	Certificate of Analysis	Mar 23, 2022	T119208
E2231203	Certificate of Analysis	Mar 23, 2022	T119208

Chemical and Physical Properties

Sensitivity	Moisture Sensitive
Refractive Index	1.4000-1.4040
Flash Point(°C)	35 °C
Molecular Weight	148.200 g/mol
XLogP3	1.200
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	4
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	78.600
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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