4-Benzyloxybenzaldehyde - ≥98% , CAS No.4397-53-9

CAS: 4397-53-9 Cat. No.: B108010 Peso molecular: 212.24 Beilstein Registry Number: 1242385 Número EC: 224-527-2
Disponible para pedir
GRADE & PURITY ≥98%
Synonyms
BB 0243317 | 5-Nitro-4,6-dihydroxypyrimidine | BIM-0014979.P001 | NSC 28298 | Acrylic acid, dodecyl ester | (2-phenylethyl)urea | DTXSID5051862 | 4-(Phenylmethoxy)benzaldehyde | 4-(phenylmethoxy)-benzaldehyde | SCHEMBL158270 | DTXSID5063441 | NSC 131669 |
Storage
Store at 2-8°C,Argon charged
Shipped In
Wet ice
 ·  off list, applied to all prices below.
Size
Estado
Price
Qty
5g
B108010-5g
3
9,90US$
10g
B108010-10g
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.
10,90US$
25g
B108010-25g
3

15,90US$

23,90US$
Guardar 8,00 US$ (33.47%)
100g
B108010-100g
3

48,90US$

73,90US$
Guardar 25,00 US$ (33.83%)
500g
B108010-500g
1

142,90US$

214,90US$
Guardar 72,00 US$ (33.50%)
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,Argon charged 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.

Descripción general

4-(Benzyloxy)benzaldehyde was used in the synthesis of (5-fluoro-(2R*,3S*)-2,3-bis(4-hydroxyphenyl)pentanenitrile),an estrogen receptor β-selective ligand.
4-Benzyloxybenzaldehyde is used in the synthesis of (5-fluoro-(2R*,3S*)-2,3-bis(4-hydroxyphenyl)pentanenitrile),an estrogen receptor β-selective ligand. It is a position isomer of the adenylyl cyclase activator 2-benzyloxybenzaldehyde.

Specifications

Sinónimos
BB 0243317 | 5-Nitro-4, 6-dihydroxypyrimidine | BIM-0014979.P001 | NSC 28298 | Acrylic acid, dodecyl ester | (2-phenylethyl)urea | DTXSID5051862 | 4-(Phenylmethoxy)benzaldehyde | 4-(phenylmethoxy)-benzaldehyde | SCHEMBL158270 | DTXSID5063441 | NSC 131669 |
Especificaciones y pureza
≥98%
Condiciones de almacenamiento de almacenamiento
Store at 2-8°C, Argon charged
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
Pubchem Sid504755251
Pubchem Sid Urlhttps://pubchem.ncbi.nlm.nih.gov/substance/504755251
Sonrisas canónicasC1=CC=C(C=C1)COC2=CC=C(C=C2)C=O
IUPAC Name4-phenylmethoxybenzaldehyde
InChIKeyZVTWZSXLLMNMQC-UHFFFAOYSA-N
INCHI1S/C14H12O2/c15-10-12-6-8-14(9-7-12)16-11-13-4-2-1-3-5-13/h1-10H,11H2
Isómeros SMILES C1=CC=C(C=C1)COC2=CC=C(C=C2)C=O
WGK Alemania 3
Peso molecular 212.24
Beilstein 1242385
Reaxy-Rn 1242385
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1242385&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
ClasePhenol ethers
SubclassNot available
Intermediate Tree Nodes Not available
Direct ParentPhenol ethers
Alternative Parents Phenoxy compounds  Benzoyl derivatives  Benzaldehydes  Alkyl aryl ethers  Organic oxides  Hydrocarbon derivatives  
Molecular FrameworkAromatic homomonocyclic compounds
Substituents Phenoxy compound - Phenol ether - Benzoyl - Benzaldehyde - Aryl-aldehyde - Alkyl aryl ether - Monocyclic benzene moiety - Ether - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Aldehyde - Aromatic homomonocyclic compound
DescripciónThis compound belongs to the class of organic compounds known as phenol ethers. These are aromatic compounds containing an ether group substituted with a benzene ring.
External Descriptors Not available
Estructura 3D
Modelo de Estructura Química Interactiva





Objetivos asociados (humanos)
SLC6A1 Tclin GABA transporter 1 (308 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Objetivos asociados (no humanos)
Staphylococcus aureus (210822 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Escherichia coli (133304 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Rattus norvegicus (775804 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Mecanismos de acción
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.

10 results found

Lot NumberCertificate TypeFechaArticulo
B2225468Certificate of AnalysisDec 12, 2025 B108010
I2104095Certificate of AnalysisJun 09, 2025 B108010
I2104207Certificate of AnalysisJun 09, 2025 B108010
G2426612Certificate of AnalysisJun 25, 2024 B108010
G2426613Certificate of AnalysisJun 25, 2024 B108010
H2525018Certificate of AnalysisSep 24, 2022 B108010
J2229034Certificate of AnalysisSep 24, 2022 B108010
J2229071Certificate of AnalysisSep 24, 2022 B108010
J2229074Certificate of AnalysisSep 24, 2022 B108010
J2229075Certificate of AnalysisSep 24, 2022 B108010
Propiedades químicas y físicas
SolubilidadInsoluble in water.
SensibilidadAir sensitive
Punto de ebullición (°C)219°C/13mmHg
Punto de fusión (°C)71-74°C
Peso molecular212.240 g/mol
XLogP33.300
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count4
Exact Mass212.084 Da
Monoisotopic Mass212.084 Da
Topological Polar Surface Area26.300 Ų
Heavy Atom Count16
Formal Charge0
Complexity201.000
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 soluciones
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