Cas no 862713-26-6 (3-(4-bromo-2-chlorophenoxy)methylbenzoic acid)
3-(4-Bromo-2-chlorophenoxy)methylbenzoic acid is a halogenated aromatic compound featuring both bromo and chloro substituents on its phenoxy moiety, coupled with a benzoic acid functional group. This structure confers versatility in synthetic applications, particularly as an intermediate in pharmaceutical and agrochemical research. The presence of electron-withdrawing halogens enhances reactivity in electrophilic substitution and coupling reactions, while the carboxylic acid group allows for further derivatization. Its well-defined molecular architecture makes it valuable for constructing complex heterocycles or bioactive molecules. The compound’s stability under standard conditions ensures consistent performance in multi-step syntheses. Suitable for controlled functionalization, it is often employed in the development of targeted small-molecule inhibitors or specialty chemicals.
862713-26-6 structure
Product Name:3-(4-bromo-2-chlorophenoxy)methylbenzoic acid
CAS No:862713-26-6
MF:C14H10BrClO3
MW:341.584402561188
MDL:MFCD03421919
CID:3030758
PubChem ID:7015993
Update Time:2025-10-29
3-(4-bromo-2-chlorophenoxy)methylbenzoic acid Chemical and Physical Properties
Names and Identifiers
-
- 3-(4-BROMO-2-CHLORO-PHENOXYMETHYL)-BENZOIC ACID
- 3-(4-bromo-2-chlorophenoxy)methylbenzoic acid
- CS-0269078
- 3-((4-Bromo-2-chlorophenoxy)methyl)benzoic acid
- STK349144
- AKOS000308449
- 862713-26-6
- 3-[(4-bromo-2-chlorophenoxy)methyl]benzoic acid
- 3-(4-bromo-2-chlorophenoxymethyl)benzoic acid
- MJB71326
- EN300-228617
- MFCD03421919
- BBL039696
- 3-[(4-bromo-2-chlorophenoxy)methyl]benzoicacid
-
- MDL： MFCD03421919
- Inchi： 1S/C14H10BrClO3/c15-11-4-5-13(12(16)7-11)19-8-9-2-1-3-10(6-9)14(17)18/h1-7H,8H2,(H,17,18)
- InChI Key： UXDCDGQGXBIOAT-UHFFFAOYSA-N
- SMILES： BrC1C=CC(=C(C=1)Cl)OCC1C=CC=C(C(=O)O)C=1
Computed Properties
- Exact Mass: 339.95018Da
- Monoisotopic Mass: 339.95018Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 19
- Rotatable Bond Count: 4
- Complexity: 313
- 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: 46.5?2
3-(4-bromo-2-chlorophenoxy)methylbenzoic acid Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| Matrix Scientific | 200507-1g |
3-[(4-Bromo-2-chlorophenoxy)methyl]benzoic acid |
862713-26-6 | 1g |
$749.00 | 2023-09-10 | ||
| Fluorochem | 028035-1g |
3-(4-Bromo-2-chloro-phenoxymethyl)-benzoic acid |
862713-26-6 | 1g |
￡210.00 | 2022-03-01 | ||
| Fluorochem | 028035-5g |
3-(4-Bromo-2-chloro-phenoxymethyl)-benzoic acid |
862713-26-6 | 5g |
￡591.00 | 2022-03-01 | ||
| Enamine | EN300-228617-0.05g |
3-[(4-bromo-2-chlorophenoxy)methyl]benzoic acid |
862713-26-6 | 95% | 0.05g |
$42.0 | 2024-06-20 | |
| Enamine | EN300-228617-0.1g |
3-[(4-bromo-2-chlorophenoxy)methyl]benzoic acid |
862713-26-6 | 95% | 0.1g |
$66.0 | 2024-06-20 | |
| Enamine | EN300-228617-0.25g |
3-[(4-bromo-2-chlorophenoxy)methyl]benzoic acid |
862713-26-6 | 95% | 0.25g |
$92.0 | 2024-06-20 | |
| Enamine | EN300-228617-0.5g |
3-[(4-bromo-2-chlorophenoxy)methyl]benzoic acid |
862713-26-6 | 95% | 0.5g |
$175.0 | 2024-06-20 | |
| Enamine | EN300-228617-1.0g |
3-[(4-bromo-2-chlorophenoxy)methyl]benzoic acid |
862713-26-6 | 95% | 1.0g |
$256.0 | 2024-06-20 | |
| Enamine | EN300-228617-2.5g |
3-[(4-bromo-2-chlorophenoxy)methyl]benzoic acid |
862713-26-6 | 95% | 2.5g |
$503.0 | 2024-06-20 | |
| Enamine | EN300-228617-5.0g |
3-[(4-bromo-2-chlorophenoxy)methyl]benzoic acid |
862713-26-6 | 95% | 5.0g |
$743.0 | 2024-06-20 |
3-(4-bromo-2-chlorophenoxy)methylbenzoic acid Related Literature
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Alvin Tanudjaja,Shinsuke Inagi,Fusao Kitamura,Toshikazu Takata,Ikuyoshi Tomita Dalton Trans., 2021,50, 3037-3043
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Raktani Bikshapathi,Sai Prathima Parvathaneni,Vaidya Jayathirtha Rao Green Chem., 2017,19, 4446-4450
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Kathrin Kutlescha,Rhett Kempe New J. Chem., 2010,34, 1954-1960
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Inês S. Albuquerque,Hélia F. Jeremias,Miguel Chaves-Ferreira,Dijana Matak-Vinkovic,Omar Boutureira,Carlos C. Rom?o Chem. Commun., 2015,51, 3993-3996
-
Chongyang Zhu,Xiaojia Bian,Xin Jia,Ning Tang,Yongqiang Cheng Food Funct., 2020,11, 10635-10644
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