sec-Butyl 4-Hydroxybenzoate - ≥98% , CAS No.17696-61-6

CAS: 17696-61-6 Cat. No.: S161062 Peso molecular: 194.23 Número EC: 241-697-3 PubChem CID: 86607
Disponible para pedir
GRADE & PURITY ≥98%
Synonyms
SEC-BUTYL P-HYDROXYBENZOATE | A881490 | Sodium diethylcarbamodithioate | 4-Hydroxybenzoic Acid sec-Butyl Ester | NCGC00249141-01 | NCGC00257425-01 | 2-(AMINOMETHYL)-1-METHYLIMIDAZOLE | 2-phenylmethoxyethanamine | 16V369U91O | DTXCID3024607 | H10606 | UNII
Storage
Store at 2-8°C
Shipped In
Wet ice
 ·  off list, applied to all prices below.
Size
Estado
Price
Qty
5g
S161062-5g
2

37,90US$

56,90US$
Guardar 19,00 US$ (33.39%)
25g
S161062-25g
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.

139,90US$

209,90US$
Guardar 70,00 US$ (33.35%)
100g
S161062-100g
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.

447,90US$

671,90US$
Guardar 224,00 US$ (33.34%)
Enter a quantity for the sizes you want to add.
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Why this grade

≥98% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

🌡

Storage & shipping

Store at 2-8°C Ships Wet ice 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
SEC-BUTYL P-HYDROXYBENZOATE | A881490 | Sodium diethylcarbamodithioate | 4-Hydroxybenzoic Acid sec-Butyl Ester | NCGC00249141-01 | NCGC00257425-01 | 2-(AMINOMETHYL)-1-METHYLIMIDAZOLE | 2-phenylmethoxyethanamine | 16V369U91O | DTXCID3024607 | H10606 | UNII
Especificaciones y pureza
≥98%
Condiciones de almacenamiento de almacenamiento
Store at 2-8°C
Enviado en
Wet ice
Este producto requiere envío en cadena de frío. Los servicios terrestres y otros servicios económicos no están disponibles.
Pureza
≥98%
Nombres e identificadores
Sonrisas canónicasCCC(C)OC(=O)C1=CC=C(C=C1)O
IUPAC Namebutan-2-yl 4-hydroxybenzoate
InChIKeyZUOTXZHOGPQFIU-UHFFFAOYSA-N
INCHI1S/C11H14O3/c1-3-8(2)14-11(13)9-4-6-10(12)7-5-9/h4-8,12H,3H2,1-2H3
Isómeros SMILES CCC(C)OC(=O)C1=CC=C(C=C1)O
PubChem CID 86607
Peso molecular 194.23
Reaxy-Rn 2642003

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
ClaseBenzene 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
DescripciónThis 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
Estructura 3D
Modelo de Estructura Química Interactiva





Certificados (CoA, COO, BSE/TSE y tabla de análisis)
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.

5 results found

Lot NumberCertificate TypeFechaArticulo
J2515576Certificate of AnalysisJul 01, 2025 S161062
J2515577Certificate of AnalysisJul 01, 2025 S161062
J2515603Certificate of AnalysisJul 01, 2025 S161062
D2528220Certificate of AnalysisApr 22, 2025 S161062
D2528235Certificate of AnalysisApr 22, 2025 S161062
Propiedades químicas y físicas
SolubilidadSoluble in Methanol
Punto de ebullición (°C)210°C/25mmHg(lit.)
Punto de fusión (°C)60 °C
Peso molecular194.230 g/mol
XLogP32.700
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
Complexity183.000
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
The total count of all stereochemical bonds0
Covalently-Bonded Unit Count1
Calculadoras de soluciones
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