Cas no 952183-54-9 (Methyl 3-(ethylamino)-4-nitrobenzoate)
Methyl 3-(ethylamino)-4-nitrobenzoate is a nitro-substituted benzoate ester derivative with applications in organic synthesis and pharmaceutical research. Its structure features an ethylamino group at the 3-position and a nitro group at the 4-position, contributing to its reactivity as an intermediate in the preparation of more complex molecules. The compound is valued for its potential use in the development of dyes, agrochemicals, and bioactive compounds due to its electron-withdrawing nitro group and modifiable ester functionality. It offers synthetic versatility, enabling further functionalization through reduction, hydrolysis, or substitution reactions. Proper handling is recommended due to the presence of the nitro group, which may pose stability concerns under certain conditions.
952183-54-9 structure
Product Name:Methyl 3-(ethylamino)-4-nitrobenzoate
CAS No:952183-54-9
MF:C10H12N2O4
MW:224.213282585144
MDL:MFCD09607946
CID:1074191
PubChem ID:24213829
Update Time:2025-06-09
Methyl 3-(ethylamino)-4-nitrobenzoate Chemical and Physical Properties
Names and Identifiers
-
- Methyl 3-(ethylamino)-4-nitrobenzenecarboxylate
- methyl 3-(ethylamino)-4-nitrobenzoate
- SY317205
- CS-0187481
- FT-0754377
- methyl3-(ethylamino)-4-nitrobenzoate
- SCHEMBL2019450
- DB-0700
- 952183-54-9
- MFCD09607946
- DTXSID90640015
- AKOS005072216
- SB80388
- D97629
- CNB18354
- DA-32825
- Methyl 3-(ethylamino)-4-nitrobenzoate
-
- MDL: MFCD09607946
- Inchi: 1S/C10H12N2O4/c1-3-11-8-6-7(10(13)16-2)4-5-9(8)12(14)15/h4-6,11H,3H2,1-2H3
- InChI Key: MDUFKGRSLMVNCE-UHFFFAOYSA-N
- SMILES: O(C)C(C1C=CC(=C(C=1)NCC)[N+](=O)[O-])=O
Computed Properties
- Exact Mass: 224.07970687g/mol
- Monoisotopic Mass: 224.07970687g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 16
- Rotatable Bond Count: 5
- Complexity: 264
- 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: 2.5
- Topological Polar Surface Area: 84.2?2
Methyl 3-(ethylamino)-4-nitrobenzoate Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| SHANG HAI XIAN DING Biotechnology Co., Ltd. | B-TF187-200mg |
Methyl 3-(ethylamino)-4-nitrobenzoate |
952183-54-9 | 98% | 200mg |
147.0CNY | 2021-07-14 | |
| SHANG HAI XIAN DING Biotechnology Co., Ltd. | B-TF187-1g |
Methyl 3-(ethylamino)-4-nitrobenzoate |
952183-54-9 | 98% | 1g |
482.0CNY | 2021-07-14 | |
| SHANG HAI XIAN DING Biotechnology Co., Ltd. | B-TF187-50mg |
Methyl 3-(ethylamino)-4-nitrobenzoate |
952183-54-9 | 98% | 50mg |
61.0CNY | 2021-07-14 | |
| TRC | M305023-100mg |
Methyl 3-(ethylamino)-4-nitrobenzoate |
952183-54-9 | 100mg |
$64.00 | 2023-05-17 | ||
| TRC | M305023-250mg |
Methyl 3-(ethylamino)-4-nitrobenzoate |
952183-54-9 | 250mg |
$75.00 | 2023-05-17 | ||
| TRC | M305023-500mg |
Methyl 3-(ethylamino)-4-nitrobenzoate |
952183-54-9 | 500mg |
$87.00 | 2023-05-17 | ||
| TRC | M305023-1g |
Methyl 3-(ethylamino)-4-nitrobenzoate |
952183-54-9 | 1g |
$98.00 | 2023-05-17 | ||
| abcr | AB257988-500 mg |
Methyl 3-(ethylamino)-4-nitrobenzenecarboxylate, 95%; . |
952183-54-9 | 95% | 500MG |
€138.50 | 2023-01-25 | |
| abcr | AB257988-1 g |
Methyl 3-(ethylamino)-4-nitrobenzenecarboxylate, 95%; . |
952183-54-9 | 95% | 1g |
€138.50 | 2023-04-27 | |
| eNovation Chemicals LLC | Y1054482-5g |
methyl 3-(ethylamino)-4-nitrobenzenecarboxylate |
952183-54-9 | 98% | 5g |
$175 | 2024-06-06 |
Methyl 3-(ethylamino)-4-nitrobenzoate Related Literature
-
Guang Xu,Wei Zhang,Ying Zhang,Xiaoxia Zhao,Ping Wen,Di Ma RSC Adv., 2018,8, 19353-19361
-
Tao Wang,Yangyang Liu,Yue Deng,Hongbo Fu,Jianmin Chen Environ. Sci.: Nano, 2018,5, 1821-1833
-
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
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