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· · COA & SDS Disponibile per ogni prodotto · Spedizione lo stesso giorno su articoli in magazzino 4-Chlorobenzoic acid(4-CBA) - for synthesis , CAS No.74-11-3
GRADE & PURITY for Synthesis ? Synthesis grade — practical purity for chemical synthesis and preparative work. Use as a cost-effective reagent when analytical purity isn't required. Synonyms
S3 (4-chlorobenzoic acid) | para-Chlorobenzoic acid | Benzoic acid, 4-chloro- | 4-Chlorobenzoic acid, 99% | Tox21_400062 | 4-Chlorobenzoic acid, Vetec(TM) reagent grade, 98% | FT-0618183 | 4-Chlorobenzoic acid, analytical standard | p-Chlorbenzoic acid |
Storage
Room temperature,Desiccated
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Why this grade for synthesis per la sintesi for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
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Storage & shipping Room temperature,Desiccated Ships Normal Check lot-specific COA for exact specifications.
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Quality documents SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.
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Literature proof Cited in 92 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
Panoramica Application
4-Chlorobenzoic acid for synthesis. CAS 74-11-3, chemical formula 4-(Cl)C₆H₄COOH.
Specifications Sinonimi
S3 (4-chlorobenzoic acid) | para-Chlorobenzoic acid | Benzoic acid, 4-chloro- | 4-Chlorobenzoic acid, 99% | Tox21_400062 | 4-Chlorobenzoic acid, Vetec(TM) reagent grade, 98% | FT-0618183 | 4-Chlorobenzoic acid, analytical standard | p-Chlorbenzoic acid |
Specifiche e purezza
for synthesis
Condizioni di conservazione di stoccaggio
Room temperature,Desiccated
Nomi e identificatori Pubchem Sid Url
https://pubchem.ncbi.nlm.nih.gov/substance/504751062
Sorrisi canonici
C1=CC(=CC=C1C(=O)O)Cl
IUPAC Name
4-chlorobenzoic acid
InChIKey
XRHGYUZYPHTUJZ-UHFFFAOYSA-N
INCHI
1S/C7H5ClO2/c8-6-3-1-5(2-4-6)7(9)10/h1-4H,(H,9,10)
Isomeri SMILES
C1=CC(=CC=C1C(=O)O)Cl
Reaxys-RN_link_address
https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=907196&ln=
Documentazione 📋 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 Kingdom Organic compounds Superclass Benzenoids Classe Benzene and substituted derivatives Subclass Benzoic acids and derivatives Intermediate Tree Nodes Halobenzoic acids and derivatives Direct Parent Halobenzoic acids Alternative Parents 4-halobenzoic acids Benzoic acids Benzoyl derivatives Chlorobenzenes Aryl chlorides Monocarboxylic acids and derivatives Carboxylic acids Organooxygen compounds Organochlorides Organic oxides Hydrocarbon derivatives Molecular Framework Aromatic homomonocyclic compounds Substituents 4-halobenzoic acid or derivatives - 4-halobenzoic acid - Halobenzoic acid - Benzoic acid - Benzoyl - Halobenzene - Chlorobenzene - Aryl halide - Aryl chloride - Monocarboxylic acid or derivatives - Carboxylic acid - Carboxylic acid derivative - Organic oxide - Organooxygen compound - Organochloride - Organohalogen compound - Organic oxygen compound - Hydrocarbon derivative - Aromatic homomonocyclic compound Descrizione This compound belongs to the class of organic compounds known as halobenzoic acids. These are benzoic acids carrying a halogen atom on the benzene ring. External Descriptors monochlorobenzoic acid Data sources 1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.
Struttura 3D Obiettivi associati (umani) Obiettivi associati (non umani) Meccanismi d'azione Certificati (CoA, COO, BSE/TSE e tabella di analisi) Proprietà chimiche e fisiche Solubilità 0.08g/L Punto di infiammabilità (°F) 460.4 °F Punto di infiammabilità (°C) 238℃ Punto di ebollizione (°C) 274-276°C Punto di fusione (°C) 243°C Peso molecolare 156.560 g/mol XLogP3 2.700 Hydrogen Bond Donor Count 1 Hydrogen Bond Acceptor Count 2 Rotatable Bond Count 1 Exact Mass 155.998 Da Monoisotopic Mass 155.998 Da Topological Polar Surface Area 37.300 Ų Heavy Atom Count 10 Formal Charge 0 Complexity 128.000 Isotope Atom Count 0 Defined Atom Stereocenter Count 0 Undefined Atom Stereocenter Count 0 Defined Bond Stereocenter Count 0 Undefined Bond Stereocenter Count 0 The total count of all stereochemical bonds 0 Covalently-Bonded Unit Count 1
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