1,3-Dibenzoyloxybenzene - ≥98% , CAS No.94-01-9

CAS: 94-01-9 Cat. No.: D404095 Peso molecular: 318.33 Número EC: 202-294-8
Disponible para pedir
GRADE & PURITY ≥98%
Synonyms
1,3-Benzenediol, 1,3-dibenzoate | SUQGLJRNDJRARS-UHFFFAOYSA-N | MFCD00016576 | D90376 | NSC33405 | NSC-33405 | UNII-TO6NXP18UZ | NSC4906 | NSC-4906 | SCHEMBL1785471 | EINECS 202-294-8 | AKOS003646463 | 1,3-Phenylenedibenzoate | AH-357/02159001 | Oprea1_08
Storage
Room temperature
 ·  off list, applied to all prices below.
Size
Estado
Price
Qty
1g
D404095-1g
6

9,90US$

16,90US$
Guardar 7,00 US$ (41.42%)
5g
D404095-5g
4

35,90US$

56,90US$
Guardar 21,00 US$ (36.91%)
25g
D404095-25g
5

145,90US$

226,90US$
Guardar 81,00 US$ (35.70%)
Enter a quantity for the sizes you want to add.
🧪

Why this grade

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

🌡

Storage & shipping

Room temperature Ships 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
1, 3-Benzenediol, 1, 3-dibenzoate | SUQGLJRNDJRARS-UHFFFAOYSA-N | MFCD00016576 | D90376 | NSC33405 | NSC-33405 | UNII-TO6NXP18UZ | NSC4906 | NSC-4906 | SCHEMBL1785471 | EINECS 202-294-8 | AKOS003646463 | 1, 3-Phenylenedibenzoate | AH-357/02159001 | Oprea1_08
Especificaciones y pureza
≥98%
Condiciones de almacenamiento de almacenamiento
Room temperature
Pureza
≥98%
Nombres e identificadores
Pubchem Sid488183840
Pubchem Sid Urlhttps://pubchem.ncbi.nlm.nih.gov/substance/488183840
Sonrisas canónicasC1=CC=C(C=C1)C(=O)OC2=CC(=CC=C2)OC(=O)C3=CC=CC=C3
IUPAC Name(3-benzoyloxyphenyl) benzoate
InChIKeySUQGLJRNDJRARS-UHFFFAOYSA-N
INCHI1S/C20H14O4/c21-19(15-8-3-1-4-9-15)23-17-12-7-13-18(14-17)24-20(22)16-10-5-2-6-11-16/h1-14H
Isómeros SMILES C1=CC=C(C=C1)C(=O)OC2=CC(=CC=C2)OC(=O)C3=CC=CC=C3
RTECS VH0590000
Peso molecular 318.33
Reaxy-Rn 2059467
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2059467&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
SuperclassPhenylpropanoids and polyketides
ClaseDepsides and depsidones
SubclassNot available
Intermediate Tree Nodes Not available
Direct ParentDepsides and depsidones
Alternative Parents Phenol esters  Benzoic acid esters  Phenoxy compounds  Benzoyl derivatives  Dicarboxylic acids and derivatives  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 - Monocyclic benzene moiety - Benzenoid - Dicarboxylic acid or derivatives - Carboxylic acid ester - Carboxylic acid derivative - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organooxygen compound - Aromatic homomonocyclic compound
DescripciónThis 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
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.

6 results found

Lot NumberCertificate TypeFechaArticulo
D2321834Certificate of AnalysisFeb 05, 2026 D404095
D2321845Certificate of AnalysisFeb 05, 2026 D404095
D2321847Certificate of AnalysisFeb 05, 2026 D404095
D2321910Certificate of AnalysisFeb 05, 2026 D404095
D2321923Certificate of AnalysisFeb 05, 2026 D404095
D2321953Certificate of AnalysisFeb 05, 2026 D404095
Propiedades químicas y físicas
SolubilidadSoluble in Acetone
Punto de fusión (°C)118 °C
Peso molecular318.300 g/mol
XLogP35.000
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count6
Exact Mass318.089 Da
Monoisotopic Mass318.089 Da
Topological Polar Surface Area52.600 Ų
Heavy Atom Count24
Formal Charge0
Complexity383.000
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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