Benzoic acid 3-Hydroxy-5-methylphenyl ester - ≥95% , CAS No.848130-90-5

CAS: 848130-90-5 Cat. No.: B331703 Formula: C14H12O3 Peso molecolare: 228.24
Disponibile su ordine
GRADE & PURITY ≥95%
Synonyms
1,3-Benzenediol,5-methyl-, 1-benzoate
Storage
Room temperature
Shipped In
Normal
★
Size
Germania (EU)
USA*
Price
Qty
250mg
B331703-250mg
—
3 Disponibile

71,07€

106,65€
Salva 35,58 € (33.36%)
1g
B331703-1g
—
2 Disponibile

190,82€

286,27€
Salva 95,45 € (33.34%)
5g
B331703-5g
Su ordinazione · 8–12 settimane

715,80€

1.074,17€
Salva 358,38 € (33.36%)
Enter a quantity for the sizes you want to add.
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Why this grade

≥95% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

🌡

Storage & shipping

Room temperature 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

Sinonimi
1,3-Benzenediol,5-methyl-, 1-benzoate
Specifiche e purezza
≥95%
Condizioni di conservazione di stoccaggio
Room temperature
Spedito in
Normal
Purezza
≥95%
Nomi e identificatori
Pubchem Sid504770102
Pubchem Sid Urlhttps://pubchem.ncbi.nlm.nih.gov/substance/504770102
Sorrisi canoniciCC1=CC(=CC(=C1)OC(=O)C2=CC=CC=C2)O
IUPAC Name(3-hydroxy-5-methylphenyl) benzoate
InChIKeyHYLQICWQHBSZQZ-UHFFFAOYSA-N
INCHI1S/C14H12O3/c1-10-7-12(15)9-13(8-10)17-14(16)11-5-3-2-4-6-11/h2-9,15H,1H3
Isomeri SMILES CC1=CC(=CC(=C1)OC(=O)C2=CC=CC=C2)O
Peso molecolare 228.24
Reaxy-Rn 3546070
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=3546070&ln=

Documentazione

📋 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
SuperclassPhenylpropanoids and polyketides
ClasseDepsides and depsidones
SubclassNot available
Intermediate Tree Nodes Not available
Direct ParentDepsides and depsidones
Alternative Parents Phenol esters  Benzoic acid esters  Phenoxy compounds  Meta cresols  Benzoyl derivatives  Toluenes  1-hydroxy-4-unsubstituted benzenoids  1-hydroxy-2-unsubstituted benzenoids  Carboxylic acid esters  Organooxygen compounds  Organic oxides  Hydrocarbon derivatives  
Molecular FrameworkAromatic homomonocyclic compounds
Substituents Depside backbone - Benzoate ester - Phenol ester - Benzoic acid or derivatives - Phenoxy compound - Benzoyl - M-cresol - 1-hydroxy-4-unsubstituted benzenoid - 1-hydroxy-2-unsubstituted benzenoid - Toluene - Phenol - Monocyclic benzene moiety - Benzenoid - Carboxylic acid ester - Carboxylic acid derivative - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Aromatic homomonocyclic compound
DescrizioneThis compound belongs to the class of organic compounds known as depsides and depsidones. These are polycyclic compounds that is either a polyphenolic compound composed of two or more monocyclic aromatic units linked by an ester bond (depside), or a compound containing the depsidone structure (depsidone).
External Descriptors Not available
Struttura 3D
Modello di struttura chimica interattiva





Certificati (CoA, COO, BSE/TSE e tabella di analisi)
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 NumberCertificate TypeDataOggetto
F2507051Certificate of AnalysisJun 21, 2025 B331703
B2209388Certificate of AnalysisNov 19, 2024 B331703
B2209391Certificate of AnalysisNov 19, 2024 B331703
B2209419Certificate of AnalysisNov 19, 2024 B331703
Proprietà chimiche e fisiche
Peso molecolare228.240 g/mol
XLogP33.300
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count3
Exact Mass228.079 Da
Monoisotopic Mass228.079 Da
Topological Polar Surface Area46.500 Ų
Heavy Atom Count17
Formal Charge0
Complexity258.000
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
Calcolatori di soluzioni
Recensioni

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