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Methyl Vanillate - 99%, high purity , CAS No.3943-74-6

4 Citations COA COA
    Grade & Purity:
  • ≥99%
In stock
Item Number
M102757
Grouped product items
SKU Size
Availability
 Price Qty
M102757-5g
5g
10
$29.90
M102757-25g
25g
8
$132.90
M102757-100g
100g
1
$477.90
M102757-500g
500g
Available within 4-8 weeks(?)
Items will be manufactured post-order and can take 4-8 weeks. Thank you for your patience!
$2,146.90
Wish List
Bulk Order  SDS  DATASHEET  Specification Sheet
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Basic Description

Synonyms 3-methoxy-4-(hydroxy)benzoic acid methyl ester | 4-hydroxy-5-methoxy-benzoic acid methyl ester | AKOS000120673 | Methyl 4-hydroxy-3-methoxybenzoate | methyl 4-hydroxy-3-methoxy-benzoate | BENZOIC ACID, 4-HYDROXY-3-METHOXY-, METHYL ESTER | Q27097897 | 4-Hy
Specifications & Purity ≥99%
Shipped In Normal
Product Description

Methyl vanillate is a volatile compound present in cloudberries (Rubus Chamaemorus.).

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
Superclass Benzenoids
Class Benzene and substituted derivatives
Subclass Benzoic acids and derivatives
Intermediate Tree Nodes Methoxybenzoic acids and derivatives
Direct Parent M-methoxybenzoic acids and derivatives
Alternative Parents p-Hydroxybenzoic acid alkyl esters  Methoxyphenols  Phenoxy compounds  Methoxybenzenes  Benzoyl derivatives  Anisoles  Alkyl aryl ethers  1-hydroxy-2-unsubstituted benzenoids  Methyl esters  Monocarboxylic acids and derivatives  Organic oxides  Hydrocarbon derivatives  
Molecular Framework Aromatic homomonocyclic compounds
Substituents P-hydroxybenzoic acid alkyl ester - P-hydroxybenzoic acid ester - M-methoxybenzoic acid or derivatives - Methoxyphenol - Benzoate ester - Phenoxy compound - Anisole - Methoxybenzene - Benzoyl - Phenol ether - 1-hydroxy-2-unsubstituted benzenoid - Alkyl aryl ether - Phenol - Methyl ester - Carboxylic acid ester - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Ether - Organic oxygen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Aromatic homomonocyclic compound
Description This compound belongs to the class of organic compounds known as m-methoxybenzoic acids and derivatives. These are benzoic acids in which the hydrogen atom at position 3 of the benzene ring is replaced by a methoxy group.
External Descriptors aromatic ether - phenols - benzoate ester

Associated Targets(Human)

LoVo (4724 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
MCF7 (126967 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
PC-3 (62116 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
T98G (1524 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
A549 (127892 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
OE33 (225 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID

Associated Targets(non-human)

Ralstonia solanacearum (520 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
Agrobacterium tumefaciens (620 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
Micrococcus luteus (7463 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
Staphylococcus aureus (210822 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
Escherichia coli (133304 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
Salmonella enteritidis (727 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
Bacillus cereus (7522 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
Candida albicans (78123 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
RBL-2H3 (1162 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
B16-F10 (4610 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
Pseudomonas tolaasii (36 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
Trichophyton mentagrophytes (4846 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
PPO Polyphenol oxidase (10 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID

Mechanisms of Action

Mechanism of Action Action Type target ID Target Name Target Type Target Organism Binding Site Name References

Names and Identifiers

Pubchem Sid 488182566
Pubchem Sid Url https://pubchem.ncbi.nlm.nih.gov/substance/488182566
IUPAC Name methyl 4-hydroxy-3-methoxybenzoate
INCHI InChI=1S/C9H10O4/c1-12-8-5-6(9(11)13-2)3-4-7(8)10/h3-5,10H,1-2H3
InChIKey BVWTXUYLKBHMOX-UHFFFAOYSA-N
Smiles COC1=C(C=CC(=C1)C(=O)OC)O
Isomeric SMILES COC1=C(C=CC(=C1)C(=O)OC)O
WGK Germany 3
RTECS DH2430000
Molecular Weight 182.17
Beilstein 10(3)1410
Reaxy-Rn 1369113
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1369113&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.

8 results found

Lot Number Certificate Type Date Item
L1910087 Certificate of Analysis Jun 16, 2025 M102757
I2403522 Certificate of Analysis Jun 29, 2024 M102757
I2403521 Certificate of Analysis Jun 29, 2024 M102757
I2403523 Certificate of Analysis Jun 29, 2024 M102757
F2116320 Certificate of Analysis Mar 11, 2024 M102757
D23061711 Certificate of Analysis Mar 25, 2023 M102757
D23061712 Certificate of Analysis Mar 25, 2023 M102757
I1218045 Certificate of Analysis Sep 20, 2022 M102757

Chemical and Physical Properties

Solubility Soluble in chloroform and methanol.
Boil Point(°C) 285-287°C
Melt Point(°C) 64-67°C
Molecular Weight 182.170 g/mol
XLogP3 1.800
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 3
Exact Mass 182.058 Da
Monoisotopic Mass 182.058 Da
Topological Polar Surface Area 55.800 Ų
Heavy Atom Count 13
Formal Charge 0
Complexity 180.000
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. Weibo Zhang, Chong Chen, Yixuan Li, Fengyu Guo, Weiqian Liu, Siyuan Liu, Yanan sun, Xifan Wang, Yuemin Shen, Pengjie Wang.  (2024)  Analysis of composition and source of the key aroma compounds in stir-fried pepper tallow.  FOOD CHEMISTRY,  441  (138321). 
2. Jian Yao, Lun Gui, Qizhang Long.  (2022)  A chlorogenic acid esterase from a metagenomic library with unique substrate specificity and its application in caffeic and ferulic acid production from agricultural byproducts.  BIOCATALYSIS AND BIOTRANSFORMATION,     
3. Yao Jian, Gui Lun, Yin Shaocheng.  (2021)  A novel esterase from a soil metagenomic library displaying a broad substrate range.  AMB Express,  11  (1): (1-10). 
4. Yang, et al..  (2021)  Formaldehyde-free self-polymerization of lignin-derived monomers for synthesis of renewable phenolic resin..  International Journal of Biological Macromolecules,  166  (1312-1319). 

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