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· · COA & SDS available for every product · Same-day shipping on in-stock items 4-Propylbenzoic Acid - ≥99%(T) , CAS No.2438-05-3
Synonyms
Tox21_200839 | AC7845 | MFCD00013996 | 4-n-propyl benzoic acid | AS-10796 | p-Propyl benzoic acid | Tox21_112358 | 4-propyl benzoic acid | 4-Propylbenzoic acid, 97% | AKOS000153018 | 3P1V85E45O | Q27257838 | NCGC00258534-01 | AC-18362 | J-015477 | Isatin
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Why this grade ≥99%(T) for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
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Storage & shipping Room temperature 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 2 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
Specifications Synonyms
Tox21_200839 | AC7845 | MFCD00013996 | 4-n-propyl benzoic acid | AS-10796 | p-Propyl benzoic acid | Tox21_112358 | 4-propyl benzoic acid | 4-Propylbenzoic acid, 97% | AKOS000153018 | 3P1V85E45O | Q27257838 | NCGC00258534-01 | AC-18362 | J-015477 | Isatin
Specifications & Purity
≥99%(T)
Names and Identifiers Pubchem Sid 488187955 Pubchem Sid Url https://pubchem.ncbi.nlm.nih.gov/substance/488187955 Canonical Smiles CCCC1=CC=C(C=C1)C(=O)O IUPAC Name 4-propylbenzoic acid InChIKey ATZHGRNFEFVDDJ-UHFFFAOYSA-N INCHI 1S/C10H12O2/c1-2-3-8-4-6-9(7-5-8)10(11)12/h4-7H,2-3H2,1H3,(H,11,12) Isomeric SMILES CCCC1=CC=C(C=C1)C(=O)O PubChem CID 137601 Molecular Weight 164.2 Reaxy-Rn 1934550
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 Kingdom Organic compounds Superclass Benzenoids Class Benzene and substituted derivatives Subclass Phenylpropanes Intermediate Tree Nodes Not available Direct Parent Phenylpropanes Alternative Parents Benzoic acids Benzoyl derivatives Monocarboxylic acids and derivatives Carboxylic acids Organooxygen compounds Organic oxides Hydrocarbon derivatives Molecular Framework Aromatic homomonocyclic compounds Substituents Phenylpropane - Benzoic acid - Benzoic acid or derivatives - Benzoyl - Monocarboxylic acid or derivatives - Carboxylic acid - Carboxylic acid derivative - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Aromatic homomonocyclic compound Description This compound belongs to the class of organic compounds known as phenylpropanes. These are organic compounds containing a phenylpropane moiety. External Descriptors Not available 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.
3D Structure Associated Targets(non-human) Mechanisms of Action Certificates（CoA,COO,BSE/TSE and Analysis Chart) Chemical and Physical Properties Melt Point(°C) 142 °C Molecular Weight 164.200 g/mol XLogP3 3.400 Hydrogen Bond Donor Count 1 Hydrogen Bond Acceptor Count 2 Rotatable Bond Count 3 Exact Mass 164.084 Da Monoisotopic Mass 164.084 Da Topological Polar Surface Area 37.300 Ų Heavy Atom Count 12 Formal Charge 0 Complexity 146.000 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
Citations of This Product References 1. Xiaoya Guo, Zhiyu Yang, Zhaopei Guo, Huiyan Lai, Hanyu Meng, Meng Meng, Tong Li, Zhen Li, Jie Chen, Yuanji Feng, Xuan Pang, Huayu Tian, Xuesi Chen. (2025) A Polymeric mRNA Vaccine Featuring Enhanced Site-Specific mRNA Delivery and Inherent STING-Stimulating Performance for Tumor Immunotherapy. ADVANCED MATERIALS, [PMID:40095378 ] [10.1002/adma.202410998 ] 2. Haojie Hu, Shuofan Li, Yuanfeng Wang, Ruochen Yang, Jianxun Wu, Weilai Zhang, Chen He, Han Li, Yahe Zhang, Di Zhu, Quan Shi. (2024) Molecular characterization of petroleum acids from diverse geological origins via n-Butylsilane reduction. FUEL, [PMID: [10.1016/j.fuel.2024.132429 ]
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