Cas no 179897-93-9 (Benzoic acid, 2-bromo-3-methyl-5-nitro-, methyl ester)
179897-93-9 structure
Product Name:Benzoic acid, 2-bromo-3-methyl-5-nitro-, methyl ester
CAS No:179897-93-9
MF:C9H8BrNO4
MW:274.068121910095
CID:1370634
PubChem ID:23433653
Update Time:2025-04-20
Benzoic acid, 2-bromo-3-methyl-5-nitro-, methyl ester Chemical and Physical Properties
Names and Identifiers
-
- Benzoic acid, 2-bromo-3-methyl-5-nitro-, methyl ester
- methyl 2-bromo-3-methyl-5-nitrobenzoate
- 179897-93-9
- methyl 2-bromo-3-methyl-5nitrobenzoate
- 2-bromo-3-methyl-5-nitro-benzoic acid methyl ester
- DA-33016
- SCHEMBL4196549
- DTXSID001277989
- C90947
- RSIFUNHBKKVOFE-UHFFFAOYSA-N
-
- Inchi： 1S/C9H8BrNO4/c1-5-3-6(11(13)14)4-7(8(5)10)9(12)15-2/h3-4H,1-2H3
- InChI Key： RSIFUNHBKKVOFE-UHFFFAOYSA-N
- SMILES： BrC1C(C(=O)OC)=CC(=CC=1C)[N+](=O)[O-]
Computed Properties
- Exact Mass: 272.96364
- Monoisotopic Mass: 272.964
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 15
- Rotatable Bond Count: 2
- Complexity: 265
- 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: 72.1A^2
- XLogP3: 2.7
Experimental Properties
- PSA: 69.44
Benzoic acid, 2-bromo-3-methyl-5-nitro-, methyl ester Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| Alichem | A015009861-250mg |
Methyl 2-bromo-3-methyl-5-nitrobenzoate |
179897-93-9 | 97% | 250mg |
494.40 USD | 2021-06-21 | |
| Alichem | A015009861-500mg |
Methyl 2-bromo-3-methyl-5-nitrobenzoate |
179897-93-9 | 97% | 500mg |
847.60 USD | 2021-06-21 | |
| Alichem | A015009861-1g |
Methyl 2-bromo-3-methyl-5-nitrobenzoate |
179897-93-9 | 97% | 1g |
1,564.50 USD | 2021-06-21 | |
| Apollo Scientific | OR60272-250mg |
Methyl 2-bromo-3-methyl-5-nitrobenzoate |
179897-93-9 | 95% | 250mg |
￡60.00 | 2025-02-20 | |
| Apollo Scientific | OR60272-1g |
Methyl 2-bromo-3-methyl-5-nitrobenzoate |
179897-93-9 | 95% | 1g |
￡180.00 | 2025-02-20 | |
| Apollo Scientific | OR60272-5g |
Methyl 2-bromo-3-methyl-5-nitrobenzoate |
179897-93-9 | 95% | 5g |
￡580.00 | 2025-02-20 |
Benzoic acid, 2-bromo-3-methyl-5-nitro-, methyl ester Related Literature
-
Xixi Li,Nanwei Zhu,Ruohan Li,Qinpu Zhang Anal. Methods, 2020,12, 3376-3381
-
2. An autonomous self-optimizing flow machine for the synthesis of pyridine–oxazoline (PyOX) ligands?Eric Wimmer,Daniel Cortés-Borda,Solène Brochard,Elvina Barré,Charlotte Truchet,Fran?ois-Xavier Felpin React. Chem. Eng., 2019,4, 1608-1615
-
Xin Fu,Qing-rong Liang,Rong-guang Luo,Yan-shu Li,Xiao-ping Xiao,Lu-lu Yu,Wen-zhe Shan,Guang-qin Fan J. Mater. Chem. B, 2019,7, 3088-3099
-
Kanjun Sun,Fengting Hua,Shuzhen Cui,Yanrong Zhu,Hui Peng,Guofu Ma RSC Adv., 2021,11, 37631-37642
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