Isobutyl 4-hydroxybenzoate - ≥99% , CAS No.4247-02-3

CAS: 4247-02-3 Cat. No.: I111810 Fórmula: C11H14O3 Peso molecular: 194.23 Número CE: 224-208-8
Disponível para encomenda
GRADE & PURITY ≥99%
Synonyms
CHEBI:178256 | p-Hydroxybenzoic acid sec-butyl ester | 2-Methylpropyl 4-hydroxybenzoate | ChemDiv2_000057 | FT-0618696 | ISOBUTYL PARA HYDROXY BENZOATE | SR-01000389342-1 | 3-10-00-00308 (Beilstein Handbook Reference) | MFCD00020167 | p-Hydroxybenzoic aci
Storage
Room temperature
Shipped In
Normal
★
Size
Alemanha (EU)
USA*
Price
Qty
5g
I111810-5g
—
2 Em stock
8,59€
25g
I111810-25g
Sob encomenda · 8–12 semanas
9,46€
50g
I111810-50g
—
2 Em stock

12,93€

19,87€
Gravar 6,94 € (34.93%)
100g
I111810-100g
—
2 Em stock

22,47€

33,76€
Gravar 11,28 € (33.42%)
500g
I111810-500g
1 Em stock
1 Em stock

59,79€

90,16€
Gravar 30,37 € (33.69%)
Enter a quantity for the sizes you want to add.
🧪
Why this grade

≥99% 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 4 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Specifications

Sinónimos
CHEBI:178256 | p-Hydroxybenzoic acid sec-butyl ester | 2-Methylpropyl 4-hydroxybenzoate | ChemDiv2_000057 | FT-0618696 | ISOBUTYL PARA HYDROXY BENZOATE | SR-01000389342-1 | 3-10-00-00308 (Beilstein Handbook Reference) | MFCD00020167 | p-Hydroxybenzoic aci
Especificações e pureza
≥99%
Condições de armazenamento de armazenamento
Room temperature
Enviado em
Normal
Tipo de ação
INHIBITOR
Pureza
≥99%
Nomes e identificadores
Pubchem Sid
Pubchem Sid Url
https://pubchem.ncbi.nlm.nih.gov/substance/488182600
Sorrisos canónicos
CC(C)COC(=O)C1=CC=C(C=C1)O
IUPAC Name
2-methylpropyl 4-hydroxybenzoate
InChIKey
XPJVKCRENWUEJH-UHFFFAOYSA-N
INCHI
1S/C11H14O3/c1-8(2)7-14-11(13)9-3-5-10(12)6-4-9/h3-6,8,12H,7H2,1-2H3
SMILES isoméricas
CC(C)COC(=O)C1=CC=C(C=C1)O
WGK Alemanha
3
RTECS
DH2247000
Peso molecular
194.23
Reaxy-Rn
2642305
Reaxys-RN_link_address
https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2642305&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 Benzoyl derivatives  1-hydroxy-2-unsubstituted benzenoids  Carboxylic acid esters  Monocarboxylic acids and derivatives  Organooxygen compounds  Organic oxides  Hydrocarbon derivatives  
Molecular FrameworkAromatic homomonocyclic compounds
Substituents P-hydroxybenzoic acid alkyl ester - Benzoyl - 1-hydroxy-2-unsubstituted benzenoid - Phenol - Carboxylic acid ester - Monocarboxylic acid or derivatives - 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.

8 results found

Lot NumberCertificate TypeDataItem
A1914075Certificate of AnalysisAug 13, 2026 I111810
B2217066Certificate of AnalysisDec 10, 2025 I111810
I2102080Certificate of AnalysisJun 11, 2025 I111810
A2507119Certificate of AnalysisJan 10, 2025 I111810
G1930169Certificate of AnalysisMay 06, 2023 I111810
H1521057Certificate of AnalysisApr 13, 2023 I111810
D2320055Certificate of AnalysisNov 11, 2022 I111810
H2209479Certificate of AnalysisSep 10, 2021 I111810
Propriedades químicas e físicas
SolubilidadeSolubility in water: Practically insoluble; Very soluble in Ethanol,Acetone,Ether; Soluble in Methanol
Ponto de fusão (°C)76°C
Peso molecular194.230 g/mol
XLogP33.400
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count4
Exact Mass194.094 Da
Monoisotopic Mass194.094 Da
Topological Polar Surface Area46.500 Ų
Heavy Atom Count14
Formal Charge0
Complexity181.000
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
Citations of This Product
Calculadoras de soluções
Revisões

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