5-nitro-2-phenylbenzo[d]oxazole - ≥95% , CAS No.891-43-0

CAS: 891-43-0 Cat. No.: N698986 Peso molecular: 240.21 Número EC: 809-696-8 PubChem CID: 759401
Disponible para pedir
GRADE & PURITY ≥95%
Synonyms
Benzoxazole, 5-nitro-2-phenyl | 5-Nitro-2-phenyl-1,3-benzoxazole
Storage
Store at 2-8°C
Shipped In
Wet ice
 ·  off list, applied to all prices below.
Size
Estado
Price
Qty
250mg
N698986-250mg
3

129,90US$

194,90US$
Guardar 65,00 US$ (33.35%)
1g
N698986-1g
2

267,90US$

401,90US$
Guardar 134,00 US$ (33.34%)
5g
N698986-5g
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.

691,90US$

1.037,90US$
Guardar 346,00 US$ (33.34%)
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Why this grade

≥95% 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
Benzoxazole, 5-nitro-2-phenyl | 5-Nitro-2-phenyl-1, 3-benzoxazole
Especificaciones y pureza
≥95%
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
≥95%
Nombres e identificadores
Sonrisas canónicasC1=CC=C(C=C1)C2=NC3=C(O2)C=CC(=C3)[N+](=O)[O-]
IUPAC Name5-nitro-2-phenyl-1,3-benzoxazole
InChIKeyPBRISAFILDFQFS-UHFFFAOYSA-N
INCHI1S/C13H8N2O3/c16-15(17)10-6-7-12-11(8-10)14-13(18-12)9-4-2-1-3-5-9/h1-8H
Isómeros SMILES C1=CC=C(C=C1)C2=NC3=C(O2)C=CC(=C3)[N+](=O)[O-]
PubChem CID 759401
Peso molecular 240.21

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
SuperclassOrganoheterocyclic compounds
ClaseAzoles
SubclassOxazoles
Intermediate Tree Nodes Not available
Direct ParentPhenyl-1,3-oxazoles
Alternative Parents Benzoxazoles  Nitroaromatic compounds  Benzene and substituted derivatives  Heteroaromatic compounds  Propargyl-type 1,3-dipolar organic compounds  Oxacyclic compounds  Organic oxoazanium compounds  Azacyclic compounds  Organopnictogen compounds  Organooxygen compounds  Organonitrogen compounds  Organic oxides  Hydrocarbon derivatives  
Molecular FrameworkAromatic heteropolycyclic compounds
Substituents Phenyl-1,3-oxazole - Benzoxazole - Nitroaromatic compound - Monocyclic benzene moiety - Benzenoid - Heteroaromatic compound - C-nitro compound - Organic nitro compound - Organic oxoazanium - Oxacycle - Azacycle - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organic nitrogen compound - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organic oxide - Organopnictogen compound - Organic oxygen compound - Aromatic heteropolycyclic compound
DescripciónThis compound belongs to the class of organic compounds known as phenyl-1,3-oxazoles. These are aromatic heterocyclic compounds containing a 1,3-oxazole substituted at one or more positions by a phenyl group.
External Descriptors Not available
Estructura 3D
Modelo de Estructura Química Interactiva





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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.

3 results found

Lot NumberCertificate TypeFechaArticulo
J2529474Certificate of AnalysisAug 27, 2025 N698986
J2529476Certificate of AnalysisAug 27, 2025 N698986
J2529478Certificate of AnalysisAug 27, 2025 N698986
Propiedades químicas y físicas
Peso molecular240.210 g/mol
XLogP33.300
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count1
Exact Mass240.053 Da
Monoisotopic Mass240.053 Da
Topological Polar Surface Area71.900 Ų
Heavy Atom Count18
Formal Charge0
Complexity312.000
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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