Methyl 4-hydroxy-3-methylbenzoate - ≥97% , CAS No.42113-13-3

CAS: 42113-13-3 Cat. No.: M589082 Fórmula: C9H10O3 Peso molecular: 166.18 Número CE: 895-188-1
Disponível para encomenda
GRADE & PURITY ≥97%
Synonyms
FT-0768993 | AKOS005174516 | 4-hydroxy-3-methylbenzoic acid methyl ester | 4-Hydroxy-3-methyl-benzoic acid methyl ester | AMY28228 | METHYL 4-HYDROXY-3-METHYLBENZOATE | Methyl 4-hydroxy-3-methyl-benzoate | DTXSID60459737 | methyl 4-hydroxy-3-methyl-benzoa
Storage
Room temperature,Argon charged
Shipped In
Normal
★
Size
Alemanha (EU)
USA*
Price
Qty
1g
M589082-1g
—
1 Em stock

18,14€

27,68€
Gravar 9,55 € (34.48%)
5g
M589082-5g
—
1 Em stock

22,47€

33,76€
Gravar 11,28 € (33.42%)
10g
M589082-10g
Sob encomenda · 8–12 semanas

27,68€

41,56€
Gravar 13,88 € (33.40%)
25g
M589082-25g
Sob encomenda · 8–12 semanas

68,46€

103,17€
Gravar 34,71 € (33.64%)
Enter a quantity for the sizes you want to add.
🧪
Why this grade

≥97% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

🌡

Storage & shipping

Room temperature,Argon charged Ships Normal Check lot-specific COA for exact specifications.

📋

Quality documents

SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.

📚

Literature proof

Cited in 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Specifications

Sinónimos
FT-0768993 | AKOS005174516 | 4-hydroxy-3-methylbenzoic acid methyl ester | 4-Hydroxy-3-methyl-benzoic acid methyl ester | AMY28228 | METHYL 4-HYDROXY-3-METHYLBENZOATE | Methyl 4-hydroxy-3-methyl-benzoate | DTXSID60459737 | methyl 4-hydroxy-3-methyl-benzoa
Especificações e pureza
≥97%
Condições de armazenamento de armazenamento
Room temperature,Argon charged
Enviado em
Normal
Pureza
≥97%
Nomes e identificadores
Pubchem Sid528759009
Sorrisos canónicosCC1=C(C=CC(=C1)C(=O)OC)O
IUPAC Namemethyl 4-hydroxy-3-methylbenzoate
InChIKeyQBMHMOKIFSCFCX-UHFFFAOYSA-N
INCHI1S/C9H10O3/c1-6-5-7(9(11)12-2)3-4-8(6)10/h3-5,10H,1-2H3
SMILES isoméricas CC1=C(C=CC(=C1)C(=O)OC)O
Peso molecular 166.18
Reaxy-Rn 2830713
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2830713&ln=

Documentation

📋 Safety Data Sheet (SDS)

Comprehensive hazard, handling, storage, and regulatory compliance document.

Download SDS →

✅ Certificate of Analysis (COA)

Lot-specific quality data. Enter your lot number to retrieve the exact COA.

Look up COA →

📊 Datasheet

Quick-reference summary of product specifications and applications.

View datasheet →

🔬 Specification Sheet

Full quality attributes and acceptance criteria for this grade.

View spec sheet →

Advanced Data

Taxonomic Classification

Taxonomy Tree

KingdomOrganic compounds
SuperclassBenzenoids
ClasseBenzene and substituted derivatives
SubclassBenzoic acids and derivatives
Intermediate Tree Nodes Benzoic acid esters - p-Hydroxybenzoic acid esters
Direct Parentp-Hydroxybenzoic acid alkyl esters
Alternative Parents Ortho cresols  Benzoyl derivatives  Toluenes  1-hydroxy-2-unsubstituted benzenoids  Methyl esters  Organooxygen compounds  Organic oxides  Hydrocarbon derivatives  
Molecular FrameworkAromatic homomonocyclic compounds
Substituents P-hydroxybenzoic acid alkyl ester - O-cresol - Benzoyl - 1-hydroxy-2-unsubstituted benzenoid - Toluene - Phenol - Methyl ester - Carboxylic acid ester - Carboxylic acid derivative - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Aromatic homomonocyclic compound
DescriçãoThis compound belongs to the class of organic compounds known as p-hydroxybenzoic acid alkyl esters. These are aromatic compounds containing a benzoic acid, which is esterified with an alkyl group and para-substituted with a hydroxyl group.
External Descriptors Not available
Estrutura 3D
Modelo de Estrutura Química Interativa





Certificados(CoA,COO,BSE/TSE e Mapa de Análise)
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 NumberCertificate TypeDataItem
I2402560Certificate of AnalysisMay 30, 2024 M589082
I2402579Certificate of AnalysisMay 30, 2024 M589082
I2402580Certificate of AnalysisMay 30, 2024 M589082
I2402581Certificate of AnalysisMay 30, 2024 M589082
I2402582Certificate of AnalysisMay 30, 2024 M589082
I2402583Certificate of AnalysisMay 30, 2024 M589082
Propriedades químicas e físicas
Peso molecular166.170 g/mol
XLogP31.200
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Exact Mass166.063 Da
Monoisotopic Mass166.063 Da
Topological Polar Surface Area46.500 Ų
Heavy Atom Count12
Formal Charge0
Complexity167.000
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
The total count of all stereochemical bonds0
Covalently-Bonded Unit Count1
Calculadoras de soluções
Revisões

Avaliações dos Clientes

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