Cas no 115933-50-1 (Methyl 4-hydroxy-3-(trifluoromethyl)benzoate)
Methyl 4-hydroxy-3-(trifluoromethyl)benzoate is a fluorinated aromatic ester with the molecular formula C9H7F3O3. This compound features a trifluoromethyl group and a hydroxyl substituent on the benzoate ring, enhancing its reactivity and utility in organic synthesis. The trifluoromethyl group contributes to increased lipophilicity and metabolic stability, making it valuable in pharmaceutical and agrochemical applications. The hydroxyl group provides a site for further functionalization, enabling its use as an intermediate in the synthesis of more complex molecules. Its well-defined structure and purity ensure consistent performance in coupling reactions, esterifications, and other transformations. Suitable for research and industrial applications, it is commonly employed in the development of bioactive compounds and specialty chemicals.
115933-50-1 structure
Product Name:Methyl 4-hydroxy-3-(trifluoromethyl)benzoate
CAS No:115933-50-1
MF:C9H7F3O3
MW:220.145293474197
MDL:MFCD06204091
CID:131001
PubChem ID:13962148
Update Time:2025-10-05
Methyl 4-hydroxy-3-(trifluoromethyl)benzoate Chemical and Physical Properties
Names and Identifiers
-
- Methyl 4-hydroxy-3-(trifluoromethyl)benzoate
- Benzoic acid,4-hydroxy-3-(trifluoromethyl)-, methyl ester
- 4-Hydroxy-3-(Trifluoromethyl)-Benzoic Acid Methyl Ester
- Methyl 4-hydroxy-3-trifluoromethyl benzoate
- Methyl 3-(trifluoroMethyl)-4-hydroxybenzoate
- 4-Hydroxy-3-trifluoromethyl-benzoic acid methyl ester
- zlchem 649
- Jsp001144
- ZLD0099
- WIXKYCQCCJXQPN-UHFFFAOYSA-N
- SBB095911
- CL8572
- VZ29190
- RP05145
- BC224016
- AX8138995
- DTXSID10553370
- W-204861
- AC-1782
- FT-0723824
- METHYL 4-HYDROXY-3-TRIFLUOROMETHYLBENZOATE
- 4-Hydroxy-3-trifluoromethylbenzoic acid methyl ester
- 115933-50-1
- CS-W022854
- A803516
- SCHEMBL399738
- MFCD06204091
- FS-3265
- AKOS015908621
- 4-hydroxy-3-(trifluoromethyl)benzoic acid methyl ester
- methyl 4-oxidanyl-3-(trifluoromethyl)benzoate
- Benzoic acid, 4-hydroxy-3-(trifluoromethyl)-, methyl ester
- DA-32450
-
- MDL： MFCD06204091
- Inchi： 1S/C9H7F3O3/c1-15-8(14)5-2-3-7(13)6(4-5)9(10,11)12/h2-4,13H,1H3
- InChI Key： WIXKYCQCCJXQPN-UHFFFAOYSA-N
- SMILES： FC(C1C(=CC=C(C(=O)OC)C=1)O)(F)F
Computed Properties
- Exact Mass: 220.03500
- Monoisotopic Mass: 220.03472857g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 6
- Heavy Atom Count: 15
- Rotatable Bond Count: 2
- Complexity: 239
- 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
- Topological Polar Surface Area: 46.5
- XLogP3: 2.3
Experimental Properties
- Density: 1.382
- Boiling Point: 266.1°Cat760mmHg
- Flash Point: 114.8°C
- PSA: 46.53000
- LogP: 2.19760
Methyl 4-hydroxy-3-(trifluoromethyl)benzoate Customs Data
- HS CODE：2918290000
- Customs Data：
China Customs Code:
2918290000Overview:
2918290000 Other carboxylic acids and anhydrides containing phenolic groups but not other oxy groups\Acyl halide\Peroxides and peroxyacids and their derivatives.Regulatory conditions:AB(Customs clearance form for Inbound Goods,Customs clearance form for outbound goods).VAT:17.0%.Tax refund rate:9.0%.MFN tariff:6.5%.general tariff:30.0%
Declaration elements:
Product Name, component content, use to
Regulatory conditions:
A.Customs clearance form for Inbound Goods
B.Customs clearance form for outbound goodsInspection and quarantine category:
R.Sanitary supervision and inspection of imported food
S.Sanitary supervision and inspection of exported foodSummary:
HS: 2918290000 other carboxylic acids with phenol function but without other oxygen function, their anhydrides, halides, peroxides, peroxyacids and their derivatives Tax rebate rate:9.0% Supervision conditions:AB(certificate of inspection for goods inward,certificate of inspection for goods outward) VAT:17.0% MFN tariff:6.5% General tariff:30.0%
Methyl 4-hydroxy-3-(trifluoromethyl)benzoate Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| SHANG HAI XIAN DING Biotechnology Co., Ltd. | 076535-1g |
Methyl 4-hydroxy-3-(trifluoromethyl)benzoate |
115933-50-1 | 95+% | 1g |
6745CNY | 2021-05-07 | |
| SHANG HAI XIAN DING Biotechnology Co., Ltd. | B-RC562-5g |
Methyl 4-hydroxy-3-(trifluoromethyl)benzoate |
115933-50-1 | 98+% | 5g |
1121.0CNY | 2021-07-13 | |
| SHANG HAI XIAN DING Biotechnology Co., Ltd. | B-RC562-200mg |
Methyl 4-hydroxy-3-(trifluoromethyl)benzoate |
115933-50-1 | 98+% | 200mg |
70.0CNY | 2021-07-13 | |
| SHANG HAI XIAN DING Biotechnology Co., Ltd. | B-RC562-1g |
Methyl 4-hydroxy-3-(trifluoromethyl)benzoate |
115933-50-1 | 98+% | 1g |
300.0CNY | 2021-07-13 | |
| SHANG HAI A LA DING SHENG HUA KE JI GU FEN Co., Ltd. | M179737-25g |
Methyl 4-hydroxy-3-(trifluoromethyl)benzoate |
115933-50-1 | 95% | 25g |
￥3476.90 | 2023-09-01 | |
| SHANG HAI A LA DING SHENG HUA KE JI GU FEN Co., Ltd. | M179737-1g |
Methyl 4-hydroxy-3-(trifluoromethyl)benzoate |
115933-50-1 | 95% | 1g |
￥216.90 | 2023-09-01 | |
| SHANG HAI A LA DING SHENG HUA KE JI GU FEN Co., Ltd. | M179737-10g |
Methyl 4-hydroxy-3-(trifluoromethyl)benzoate |
115933-50-1 | 95% | 10g |
￥1544.90 | 2023-09-01 | |
| SHANG HAI A LA DING SHENG HUA KE JI GU FEN Co., Ltd. | M179737-5g |
Methyl 4-hydroxy-3-(trifluoromethyl)benzoate |
115933-50-1 | 95% | 5g |
￥926.90 | 2023-09-01 | |
| Fluorochem | 079811-1g |
Methyl 4-hydroxy-3-(trifluoromethyl)benzoate |
115933-50-1 | 95% | 1g |
￡25.00 | 2022-03-01 | |
| Fluorochem | 079811-5g |
Methyl 4-hydroxy-3-(trifluoromethyl)benzoate |
115933-50-1 | 95% | 5g |
￡96.00 | 2022-03-01 |
Methyl 4-hydroxy-3-(trifluoromethyl)benzoate Related Literature
-
Guang Xu,Wei Zhang,Ying Zhang,Xiaoxia Zhao,Ping Wen,Di Ma RSC Adv., 2018,8, 19353-19361
-
Gang Pan,Yi-jie Bao,Jie Xu,Tao Liu,Cheng Liu,Yan-yan Qiu,Xiao-jing Shi,Hui Yu,Ting-ting Jia,Xia Yuan,Ze-ting Yuan,Yi-jun Cao RSC Adv., 2016,6, 42109-42119
-
Xiaoming Liu,Zachary D. Hood,Wangda Li,Donovan N. Leonard,Arumugam Manthiram,Miaofang Chi J. Mater. Chem. A, 2021,9, 2111-2119
-
Shun-Ze Zhan,Mian Li,Xiao-Ping Zhou,Dan Li,Seik Weng Ng RSC Adv., 2011,1, 1457-1459
115933-50-1 (Methyl 4-hydroxy-3-(trifluoromethyl)benzoate) Related Products
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- 345-28-8(2-Hydroxy-4-trifluromethyl methylbenzoate)
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- 1804403-56-2(Methyl 3,5-bis(trifluoromethyl)-4-methoxybenzoate)
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