Basic Description

Synonyms	EN300-37275 \| STK503210 \| AT17170 \| LS-01700 \| SCHEMBL2031143 \| methyl-5-hydroxymethylfuran-2-carboxylate \| Methyl 5-(hydroxymethyl)-furan-2-carboxylate \| methyl 5-(hydroxymethyl)furan-2-carboxylate \| methyl 5-(hydroxymethyl)-2-furoate \| SB61574 \| methyl
Specifications & Purity	≥96%
Storage Temp	Store at -20°C,Argon charged
Shipped In	Ice chest + Ice pads This product requires cold chain shipping. Ground and other economy services are not available.
Product Description	Applicationsmethyl 5-(hydroxymethyl)furan-2-carboxylate (cas# 36802-01-4) is a useful research chemical.

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organoheterocyclic compounds
  - Class Furans
    - Subclass Furoic acid and derivatives

Kingdom	Organic compounds
Superclass	Organoheterocyclic compounds
Class	Furans
Subclass	Furoic acid and derivatives
Intermediate Tree Nodes	Not available
Direct Parent	Furoic acid esters
Alternative Parents	Methyl esters Heteroaromatic compounds Oxacyclic compounds Monocarboxylic acids and derivatives Primary alcohols Organic oxides Hydrocarbon derivatives Aromatic alcohols
Molecular Framework	Aromatic heteromonocyclic compounds
Substituents	Furoic acid ester - Heteroaromatic compound - Methyl ester - Carboxylic acid ester - Oxacycle - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Aromatic alcohol - Primary alcohol - Organooxygen compound - Alcohol - Aromatic heteromonocyclic compound
Description	This compound belongs to the class of organic compounds known as furoic acid esters. These are ester derivatives of furoic acid.
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	504767223
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/504767223
IUPAC Name	methyl 5-(hydroxymethyl)furan-2-carboxylate
INCHI	InChI=1S/C7H8O4/c1-10-7(9)6-3-2-5(4-8)11-6/h2-3,8H,4H2,1H3
InChIKey	GCVVHNKBMLQFCY-UHFFFAOYSA-N
Smiles	COC(=O)C1=CC=C(O1)CO
Isomeric SMILES	COC(=O)C1=CC=C(O1)CO
Molecular Weight	156.14
Reaxy-Rn	128773
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=128773&ln=

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.

4 results found

Lot Number	Certificate Type	Date	Item
C2508090	Certificate of Analysis	Nov 01, 2022	M335385
K2209832	Certificate of Analysis	Nov 01, 2022	M335385
K2209849	Certificate of Analysis	Nov 01, 2022	M335385
K2209854	Certificate of Analysis	Nov 01, 2022	M335385

Chemical and Physical Properties

Molecular Weight	156.140 g/mol
XLogP3	0.300
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	3
Exact Mass	156.042 Da
Monoisotopic Mass	156.042 Da
Topological Polar Surface Area	59.700 Å²
Heavy Atom Count	11
Formal Charge	0
Complexity	145.000
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

Citations of This Product

How to Cite Aladdin Scientific Products?

1. Xin Zhao, Ruiqi Fang, Zirong Shen, Fengliang Wang, Yingwei Li. (2023) Atomic decoration of Pt on Co nanoparticles for enhanced oxidative esterification performances. AICHE JOURNAL, (e18340).
2. Weizhen Xie, Binglin Chen, Wenlong Jia, Huai Liu, Zheng Li, Shuliang Yang, Xing Tang, Xianhai Zeng, Yong Sun, Xixian Ke, Tianyuan Li, Huayu Fang, Lu Lin. (2022) Base-free oxidative esterification of 5-hydroxymethylfurfural to furan-2,5-dimethylcarboxylate over n-doped carbon-supported Co/Fe bimetallic catalyst under batch-operation or continuous-flow conditions. Journal of Energy Chemistry, 75 (95).

Solution Calculators

Molarity Calculator

Determine the necessary mass, volume, or concentration for preparing a solution.

Mass

=

Concentration

x

Volume

x

M. Wt*

g/mol

*When preparing stock solutions, always use the batch-specific molecular weight of the product found on the vial label and the Certificate of Analysis (available online).

Dilution Calculator

Determine the dilution needed to prepare a stock solution.

Concentration 1 (C1)

x

Volume 1 (V1)

=

Concentration 2 (C2)

x

Volume 2 (V2)

Reconstitution Calculator

The reconstitution calculator enables you to quickly determine the volume of a reagent needed to reconstitute your vial. Just enter the mass of the reagent and the target concentration, and the calculator will do the rest.

Volume (to add to vial)

=

Mass (in vial)

÷

Desired Reconstitution Concentration

SKU	Size	Availability	Price
M335385-100mg	100mg	2	$88.90
M335385-500mg	500mg	2	$342.90
M335385-1g	1g	2	$570.90

Methyl 5-(hydroxymethyl)-2-furoate - ≥96%, high purity , CAS No.36802-01-4