Cas no 1261903-03-0 (4-Chloro-3-(4-fluoro-3-methylphenyl)benzoic acid)
4-Chloro-3-(4-fluoro-3-methylphenyl)benzoic acid is a substituted benzoic acid derivative featuring chloro, fluoro, and methyl functional groups, which contribute to its unique chemical properties. This compound is primarily utilized as an intermediate in pharmaceutical and agrochemical synthesis, where its structural motifs enable further derivatization for active ingredient development. The presence of halogen and alkyl substituents enhances its reactivity in cross-coupling and carboxylation reactions. Its well-defined aromatic framework ensures stability under various synthetic conditions, making it a reliable building block for heterocyclic and fine chemical applications. The compound is typically characterized by high purity and consistent performance in research and industrial settings.
1261903-03-0 structure
Product Name:4-Chloro-3-(4-fluoro-3-methylphenyl)benzoic acid
CAS No:1261903-03-0
MF:C14H10ClFO2
MW:264.679406642914
MDL:MFCD18319671
CID:2762375
PubChem ID:53225589
Update Time:2025-06-09
4-Chloro-3-(4-fluoro-3-methylphenyl)benzoic acid Chemical and Physical Properties
Names and Identifiers
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- 4-Chloro-3-(4-fluoro-3-methylphenyl)benzoic acid, 95%
- DTXSID70689321
- MFCD18319671
- 6-Chloro-4'-fluoro-3'-methyl[1,1'-biphenyl]-3-carboxylic acid
- 4-CHLORO-3-(4-FLUORO-3-METHYLPHENYL)BENZOIC ACID
- 1261903-03-0
- 4-Chloro-3-(4-fluoro-3-methylphenyl)benzoic acid
-
- MDL: MFCD18319671
- Inchi: 1S/C14H10ClFO2/c1-8-6-9(3-5-13(8)16)11-7-10(14(17)18)2-4-12(11)15/h2-7H,1H3,(H,17,18)
- InChI Key: BYBXLWHOKBLFIB-UHFFFAOYSA-N
- SMILES: ClC1=CC=C(C(=O)O)C=C1C1C=CC(=C(C)C=1)F
Computed Properties
- Exact Mass: 264.0353354Da
- Monoisotopic Mass: 264.0353354Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 18
- Rotatable Bond Count: 2
- Complexity: 310
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 4.2
- Topological Polar Surface Area: 37.3?2
4-Chloro-3-(4-fluoro-3-methylphenyl)benzoic acid Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| abcr | AB326744-5 g |
4-Chloro-3-(4-fluoro-3-methylphenyl)benzoic acid, 95%; . |
1261903-03-0 | 95% | 5g |
€1159.00 | 2023-04-26 | |
| abcr | AB326744-5g |
4-Chloro-3-(4-fluoro-3-methylphenyl)benzoic acid, 95%; . |
1261903-03-0 | 95% | 5g |
€1159.00 | 2025-04-21 |
4-Chloro-3-(4-fluoro-3-methylphenyl)benzoic acid Related Literature
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Yi Cao,Yujiao Xiahou,Lixiang Xing,Xiang Zhang,Hong Li,ChenShou Wu,Haibing Xia Nanoscale, 2020,12, 20456-20466
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Gerald J. Meyer,Leif Hammarstr?m Chem. Sci., 2020,11, 3460-3473
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Denis V. Korchagin,Elena A. Yureva,Alexander V. Akimov,Eugenii Ya. Misochko,Gennady V. Shilov,Artem D. Talantsev,Roman B. Morgunov,Alexander A. Shakin,Sergey M. Aldoshin,Boris S. Tsukerblat Dalton Trans., 2017,46, 7540-7548
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Jonas Kind,Lukas Kaltschnee,Martin Leyendecker,Christina M. Thiele Chem. Commun., 2016,52, 12506-12509
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