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2,3-Dihydroxy-4-methoxybenzoic acid - ≥95%, high purity , CAS No.3934-81-4

COA

Grade & Purity:

≥95%

Cas Number: 3934-81-4
Molecular Weight: 184.15
MDL number: MFCD00016499
PubChem CID: 77534

In stock

Item Number

B301227

Grouped product items
SKU	Size	Availability	Price	Qty
B301227-100mg	100mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$687.90

Discover 2,3-Dihydroxy-4-methoxybenzoic acid by Aladdin Scientific in ≥95% for only $687.90. Available - in Ligands at Aladdin Scientific. Tags: .

Basic Description

Synonyms	2,3-Dihydroxy-4-methoxybenzoic acid \| 3934-81-4 \| 2,3-Dihydroxy-p-anisic acid \| MFCD00016499 \| NSC-156949 \| EINECS 223-511-2 \| 4-Methoxy-2,3-dihydroxybenzoic acid \| NSC156949 \| UNII-3630629597 \| 2,3-DIHYDROXY-4-METHOXY BENZOIC ACID \| SCHEMBL3189109 \| DTXSID50192560 \| YGDRPEIHNMX
Specifications & Purity	≥95%
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Benzenoids
  - Class Benzene and substituted derivatives
    - Subclass Benzoic acids and derivatives
      - Level5 Methoxybenzoic acids and derivatives
        Level6 P-methoxybenzoic acids and derivatives

Kingdom	Organic compounds
Superclass	Benzenoids
Class	Benzene and substituted derivatives
Subclass	Benzoic acids and derivatives
Intermediate Tree Nodes	Methoxybenzoic acids and derivatives
Direct Parent	P-methoxybenzoic acids and derivatives
Alternative Parents	Salicylic acids Methoxyphenols Benzoic acids Phenoxy compounds Methoxybenzenes Catechols Benzoyl derivatives Anisoles Alkyl aryl ethers 1-hydroxy-4-unsubstituted benzenoids Vinylogous acids Monocarboxylic acids and derivatives Carboxylic acids Organic oxides Hydrocarbon derivatives
Molecular Framework	Aromatic homomonocyclic compounds
Substituents	P-methoxybenzoic acid or derivatives - Salicylic acid - Salicylic acid or derivatives - Methoxyphenol - Hydroxybenzoic acid - Benzoic acid - Phenoxy compound - Anisole - Methoxybenzene - Phenol ether - Benzoyl - Catechol - 1-hydroxy-4-unsubstituted benzenoid - Alkyl aryl ether - Phenol - Vinylogous acid - Carboxylic acid derivative - Carboxylic acid - Monocarboxylic acid or derivatives - Ether - Organooxygen compound - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Aromatic homomonocyclic compound
Description	This compound belongs to the class of organic compounds known as p-methoxybenzoic acids and derivatives. These are benzoic acids in which the hydrogen atom at position 4 of the benzene ring is replaced by a methoxy group.
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	2,3-dihydroxy-4-methoxybenzoic acid
INCHI	InChI=1S/C8H8O5/c1-13-5-3-2-4(8(11)12)6(9)7(5)10/h2-3,9-10H,1H3,(H,11,12)
InChIKey	YGDRPEIHNMXLJM-UHFFFAOYSA-N
Smiles	COC1=C(C(=C(C=C1)C(=O)O)O)O
Isomeric SMILES	COC1=C(C(=C(C=C1)C(=O)O)O)O
Molecular Weight	184.15
Reaxy-Rn	2693558
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2693558&ln=

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

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

Analytical Chart:

Chemical and Physical Properties

Molecular Weight	184.150 g/mol
XLogP3	1.600
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	2
Exact Mass	184.037 Da
Monoisotopic Mass	184.037 Da
Topological Polar Surface Area	87.000 Å²
Heavy Atom Count	13
Formal Charge	0
Complexity	193.000
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

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