4-Fluoro-3-nitrobenzoyl chloride - ≥95% , CAS No.400-94-2

CAS: 400-94-2 Cat. No.: F701171 Peso molecular: 203.55 Número EC: 676-294-5 PubChem CID: 2783347
Disponible para pedir
GRADE & PURITY ≥95%
Storage
Store at 2-8°C,Protected from light,Argon charged
Shipped In
Wet ice
 ·  off list, applied to all prices below.
Size
Estado
Price
Qty
1g
F701171-1g
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.
12,90US$
5g
F701171-5g
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.
38,90US$
25g
F701171-25g
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.
114,90US$
100g
F701171-100g
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.
399,90US$
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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,Protected from light,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.

Specifications

Especificaciones y pureza
≥95%
Condiciones de almacenamiento de almacenamiento
Store at 2-8°C, Protected from light, 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
≥95%
Nombres e identificadores
Sonrisas canónicasC1=CC(=C(C=C1C(=O)Cl)[N+](=O)[O-])F
IUPAC Name4-fluoro-3-nitrobenzoyl chloride
InChIKeyOJNVFOHHRJZBEG-UHFFFAOYSA-N
INCHI1S/C7H3ClFNO3/c8-7(11)4-1-2-5(9)6(3-4)10(12)13/h1-3H
Isómeros SMILES C1=CC(=C(C=C1C(=O)Cl)[N+](=O)[O-])F
PubChem CID 2783347
Peso molecular 203.55

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 Halobenzoic acids and derivatives
Direct Parent4-halobenzoic acids and derivatives
Alternative Parents Nitrobenzenes  Nitroaromatic compounds  Benzoyl derivatives  Fluorobenzenes  Aryl fluorides  Propargyl-type 1,3-dipolar organic compounds  Organic oxoazanium compounds  Acyl chlorides  Organopnictogen compounds  Organooxygen compounds  Organonitrogen compounds  Organofluorides  Organochlorides  Organic oxides  Hydrocarbon derivatives  
Molecular FrameworkAromatic homomonocyclic compounds
Substituents 4-halobenzoic acid or derivatives - Nitrobenzene - Nitroaromatic compound - Benzoyl - Fluorobenzene - Halobenzene - Aryl fluoride - Aryl halide - Organic nitro compound - C-nitro compound - Acyl chloride - Acyl halide - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Organic oxoazanium - Allyl-type 1,3-dipolar organic compound - Organohalogen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organochloride - Organofluoride - Organonitrogen compound - Organooxygen compound - Organopnictogen compound - Aromatic homomonocyclic compound
DescripciónThis compound belongs to the class of organic compounds known as 4-halobenzoic acids and derivatives. These are benzoic acids or derivatives carrying a halogen atom at the 4-position of the benzene ring.
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:
Propiedades químicas y físicas
Sensibilidadlight sensitive; air sensitive;Moisture sensitive
Punto de ebullición (°C)153°/12mm
Punto de fusión (°C)24-25°
Peso molecular203.550 g/mol
XLogP32.900
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count1
Exact Mass202.979 Da
Monoisotopic Mass202.979 Da
Topological Polar Surface Area62.900 Ų
Heavy Atom Count13
Formal Charge0
Complexity230.000
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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