- Supramolecular Control of Selectivity in Hydroformylation of Vinyl Arenes: Easy Access to Valuable β-Aldehyde IntermediatesDydio, Pawel; Reek, Joost N. H., Angewandte Chemie, 2013, 52(14), 3878-3882
Cas no 90971-88-3 (Methyl 2-bromo-5-methylbenzoate)
90971-88-3 structure
Product Name:Methyl 2-bromo-5-methylbenzoate
CAS No:90971-88-3
MF:C9H9BrO2
MW:229.070562124252
MDL:MFCD00144764
CID:799049
PubChem ID:15110996
Update Time:2024-10-26
Methyl 2-bromo-5-methylbenzoate Chemical and Physical Properties
Names and Identifiers
-
- Methyl 2-bromo-5-methylbenzoate
- Benzoic acid,2-bromo-5-methyl-, methyl ester
- 2-Bromo-5-methylbenzoic acid methyl ester
- BENZOIC ACID, 2-BROMO-5-METHYL-, METHYL ESTER
- 2-Bromo-5-methyl-benzoic acid methyl ester
- PYRAZCQFEMNXJA-UHFFFAOYSA-N
- methyl 2-bromo-5-methyl-benzoate
- AS03640
- 2-Bromo-5-methylbenzoic acid, methyl ester
- V8956
- 2-Bromo-5-methyl- Benzoic acid methyl ester
- ST24025222
- m-Toluic acid, 6-bromo-, methyl ester (7CI)
- AKOS015834891
- DA-17414
- A1-00236
- DS-15678
- CS-0046810
- 90971-88-3
- CL9610
- Methyl2-bromo-5-methylbenzoate
- MFCD00144764
- SCHEMBL221754
- DTXCID00519142
- SY104606
- EN300-270013
- DTXSID10568368
-
- MDL: MFCD00144764
- Inchi: 1S/C9H9BrO2/c1-6-3-4-8(10)7(5-6)9(11)12-2/h3-5H,1-2H3
- InChI Key: PYRAZCQFEMNXJA-UHFFFAOYSA-N
- SMILES: O=C(C1C(Br)=CC=C(C)C=1)OC
Computed Properties
- Exact Mass: 227.97900
- Monoisotopic Mass: 227.97859g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 12
- Rotatable Bond Count: 2
- Complexity: 170
- 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: 26.3
- Surface Charge: 0
- Tautomer Count: nothing
- XLogP3: 2.8
Experimental Properties
- Density: 1.433±0.06 g/cm3 (20 oC 760 Torr),
- Boiling Point: 270.1±20.0 oC (760 Torr),
- Flash Point: 117.2±21.8 oC,
- Solubility: Very slightly soluble (0.37 g/l) (25 o C),
- PSA: 26.30000
- LogP: 2.54410
Methyl 2-bromo-5-methylbenzoate Customs Data
- HS CODE:2916399090
- Customs Data:
China Customs Code:
2916399090Overview:
2916399090 Other aromatic monocarboxylic acids. VAT:17.0% Tax refund rate:9.0% Regulatory conditions:nothing MFN tariff:6.5% general tariff:30.0%
Declaration elements:
Product Name, component content, use to, Acrylic acid\Acrylates or esters shall be packaged clearly
Summary:
2916399090 other aromatic monocarboxylic acids, their anhydrides, halides, peroxides, peroxyacids and their derivatives VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0%
Methyl 2-bromo-5-methylbenzoate Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| SHANG HAI XIAN DING Biotechnology Co., Ltd. | A-YH385-25g |
Methyl2-bromo-5-methylbenzoate |
90971-88-3 | 97% | 25g |
1055.0CNY | 2021-08-04 | |
| SHANG HAI XIAN DING Biotechnology Co., Ltd. | A-YH385-1g |
Methyl2-bromo-5-methylbenzoate |
90971-88-3 | 97% | 1g |
83.0CNY | 2021-08-04 | |
| SHANG HAI XIAN DING Biotechnology Co., Ltd. | A-YH385-5g |
Methyl2-bromo-5-methylbenzoate |
90971-88-3 | 97% | 5g |
275.0CNY | 2021-08-04 | |
| SHANG HAI XIAN DING Biotechnology Co., Ltd. | A-YH385-200mg |
Methyl2-bromo-5-methylbenzoate |
90971-88-3 | 97% | 200mg |
46.0CNY | 2021-08-04 | |
| SHANG HAI MAI KE LIN SHENG HUA Technology Co., Ltd. | M857594-1g |
Methyl 2-bromo-5-methylbenzoate |
90971-88-3 | ≥98% | 1g |
¥56.70 | 2022-09-01 | |
| Fluorochem | 220175-1g |
Methyl 2-bromo-5-methylbenzoate |
90971-88-3 | 95% | 1g |
£10.00 | 2022-02-28 | |
| Fluorochem | 220175-5g |
Methyl 2-bromo-5-methylbenzoate |
90971-88-3 | 95% | 5g |
£29.00 | 2022-02-28 | |
| Fluorochem | 220175-25g |
Methyl 2-bromo-5-methylbenzoate |
90971-88-3 | 95% | 25g |
£110.00 | 2022-02-28 | |
| Fluorochem | 220175-100g |
Methyl 2-bromo-5-methylbenzoate |
90971-88-3 | 95% | 100g |
£380.00 | 2022-02-28 | |
| TRC | M295875-100mg |
Methyl 2-bromo-5-methylbenzoate |
90971-88-3 | 100mg |
$64.00 | 2023-05-18 |
Methyl 2-bromo-5-methylbenzoate Production Method
Production Method 1
Reaction Conditions
1.1 Solvents: Diethyl ether , Methanol , Toluene ; rt; 2 h, rt
Reference
Production Method 2
Reaction Conditions
1.1 Reagents: Oxalyl chloride Solvents: Dimethylformamide , Dichloromethane ; 0 °C; 1 h, rt
1.2 Solvents: Methanol ; 3 h, rt
1.3 Reagents: Sodium carbonate Solvents: Water ; neutralized, rt
1.2 Solvents: Methanol ; 3 h, rt
1.3 Reagents: Sodium carbonate Solvents: Water ; neutralized, rt
Reference
- CuCl-catalyzed one-pot synthesis of 5,6-dihydropyrazolo[1,5-c]quinazolinesGuo, Shenghai; Wang, Jiliang; Li, Yan; Fan, Xuesen, Tetrahedron, 2014, 70(14), 2383-2388
Production Method 3
Reaction Conditions
1.1 Reagents: Thionyl chloride Solvents: Methanol ; 65 °C; 8 - 9 h, 65 °C
Reference
- Synthesis, docking and biological evaluation of thiadiazole and oxadiazole derivatives as antimicrobial and antioxidant agentsZabiulla; Nagesh Khadri, M. J.; Bushra Begum, A.; Sunil, M. K.; Khanum, Shaukath Ara, Results in Chemistry, 2020, 2,
Production Method 4
Reaction Conditions
1.1 Reagents: Sulfuric acid Solvents: Methanol ; 3 h, reflux
Reference
- 3-(Adenosylthio)benzoic Acid Derivatives as SARS-CoV-2 Nsp14 Methyltransferase InhibitorsBobileva, Olga ; Bobrovs, Raitis ; Sirma, Evelina Elva; Kanepe, Iveta ; Bula, Anna L.; et al, Molecules, 2023, 28(2),
Production Method 5
Reaction Conditions
1.1 Catalysts: Sulfuric acid Solvents: Methanol ; 16 h, 65 °C; 65 °C → rt
1.2 Solvents: Water ; rt
1.2 Solvents: Water ; rt
Reference
- Selenium-Catalyzed C(sp3)-H Acyloxylation: Application in the Expedient Synthesis of IsobenzofuranonesKraetzschmar, Felix; Kassel, Martin; Delony, Daniel; Breder, Alexander, Chemistry - A European Journal, 2015, 21(19), 7030-7034
Methyl 2-bromo-5-methylbenzoate Raw materials
Methyl 2-bromo-5-methylbenzoate Preparation Products
Methyl 2-bromo-5-methylbenzoate Related Literature
-
J. Matthew Kurley,Phillip W. Halstenberg,Abbey McAlister,Stephen Raiman,Richard T. Mayes RSC Adv., 2019,9, 25602-25608
-
Gaurav J. Shah,Eric P.-Y. Chiou,Ming C. Wu,Chang-Jin “CJ” Kim Lab Chip, 2009,9, 1732-1739
-
Joseph H. Bisesi,Tara Sabo-Attwood Environ. Sci.: Nano, 2014,1, 574-583
-
Qiaoe Wang,Meiling Lian,Xiaowen Zhu,Xu Chen RSC Adv., 2021,11, 192-197
90971-88-3 (Methyl 2-bromo-5-methylbenzoate) Related Products
- 610-94-6(Methyl 2-bromobenzoate)
- 131001-86-0(Methyl 2-bromo-3-methylbenzoate)
- 18643-86-2(1,4-dimethyl 2-bromobenzene-1,4-dicarboxylate)
- 245549-92-2(Benzoic acid,2,5-dibromo-4-methyl-, methyl ester)
- 873994-34-4(Methyl 2,6-dibromobenzoate)
- 18014-00-1(Dimethyl 2,5-dibromoterephthalate)
- 87808-49-9(Methyl 2-bromo-4-methylbenzoate)
- 90766-77-1(1,3-Benzenedicarboxylic acid, 4,6-dibromo-, dimethyl ester)
- 54335-33-0(Methyl 2,4-dibromobenzoate)
- 57381-43-8(Methyl 2,5-dibromobenzoate)
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