4-hydroxy-2-methoxybenzaldehyde - ≥98%(HPLC) , CAS No.18278-34-7

CAS: 18278-34-7 Cat. No.: H132034 Fórmula: C₈H₈O₃ Peso molecular: 152.15 Beilstein Registry Number: 2045122 Número CE: 628-847-7

GRADE & PURITY ≥98%(HPLC)

Synonyms

BB 0260623 | PS-3220 | 4-Hydroxy-2-methoxybenzaldehyde | 4-hydroxy-2-methoxy-benzaldehyde | 4-Hydroxy-o-anisaldehyde | Benzaldehyde, 4-hydroxy-2-methoxy- | H1191 | 2-methoxy-4-hydroxybenzaldehyde | 2-methoxy-4-hydroxy-benzaldehyde | SCHEMBL37462 | HMS2764

Storage

Room temperature,Argon charged

Shipped In

Normal

Specifications

Sinónimos

BB 0260623 | PS-3220 | 4-Hydroxy-2-methoxybenzaldehyde | 4-hydroxy-2-methoxy-benzaldehyde | 4-Hydroxy-o-anisaldehyde | Benzaldehyde, 4-hydroxy-2-methoxy- | H1191 | 2-methoxy-4-hydroxybenzaldehyde | 2-methoxy-4-hydroxy-benzaldehyde | SCHEMBL37462 | HMS2764

Especificações e pureza

≥98%(HPLC)

Condições de armazenamento de armazenamento

Room temperature,Argon charged

Enviado em

Normal

Pureza

≥98%(HPLC)

Nomes e identificadores

Pubchem Sid

488190025

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/488190025

Sorrisos canónicos

COC1=C(C=CC(=C1)O)C=O

IUPAC Name

4-hydroxy-2-methoxybenzaldehyde

InChIKey

WBIZZNFQJPOKDK-UHFFFAOYSA-N

INCHI

1S/C8H8O3/c1-11-8-4-7(10)3-2-6(8)5-9/h2-5,10H,1H3

SMILES isoméricas

COC1=C(C=CC(=C1)O)C=O

WGK Alemanha

3

Peso molecular

152.15

Beilstein

2045122

Reaxy-Rn

2045122

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2045122&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Classe Phenols
      • Subclass Methoxyphenols

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Classe: Phenols
• Subclass: Methoxyphenols
• Intermediate Tree Nodes: Not available
• Direct Parent: Methoxyphenols
• Alternative Parents: Hydroxybenzaldehydes Phenoxy compounds Methoxybenzenes Benzoyl derivatives Anisoles Alkyl aryl ethers 1-hydroxy-2-unsubstituted benzenoids Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Methoxyphenol - Hydroxybenzaldehyde - Anisole - Benzaldehyde - Benzoyl - Phenoxy compound - Phenol ether - Methoxybenzene - Alkyl aryl ether - Aryl-aldehyde - 1-hydroxy-2-unsubstituted benzenoid - Monocyclic benzene moiety - Ether - Organooxygen compound - Aldehyde - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Aromatic homomonocyclic compound
• Descrição: This compound belongs to the class of organic compounds known as methoxyphenols. These are compounds containing a methoxy group attached to the benzene ring of a phenol moiety.
• External Descriptors: Not available

Data sources

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

Alvos associados (humanos)

CGA Tbio Glycoprotein hormones alpha chain (29278 Activities)

Discover Target: CGA

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Alvos associados (não humanos)

Plasmodium falciparum (966862 Activities)

Explore this target

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Luciferin 4-monooxygenase (66902 Activities)

Explore this target

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Mecanismos de ação

Propriedades químicas e físicas

• Solubilidade: Soluble in Methanol
• Sensibilidade: air sensitive
• Ponto de fusão (°C): 158 °C
• Peso molecular: 152.150 g/mol
• XLogP3: 1.200
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 152.047 Da
• Monoisotopic Mass: 152.047 Da
• Topological Polar Surface Area: 46.500 Ų
• Heavy Atom Count: 11
• Formal Charge: 0
• Complexity: 135.000
• 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

Perguntas frequentes

What is the purity of this product, and how is it determined?

This product is supplied at ≥98% purity, determined by HPLC. Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store at room temperature under argon. It is supplied under an argon blanket; reseal under inert gas after each use.

How is this product shipped?

This product ships under standard ambient conditions. No temperature-controlled packaging is required.

What are the CAS number, molecular formula and molecular weight?

The CAS Number is 18278-34-7, the molecular formula is C8H8O3, and the molecular weight is 152.15 g/mol. InChIKey WBIZZNFQJPOKDK-UHFFFAOYSA-N.

What documentation is provided?

Available product documentation, including Certificates of Analysis (COA), Safety Data Sheets (SDS), and specification sheets, is shown in the product document area. Document availability and access follow the current site policy.