Cas no 62554-78-3 (N-benzyl-4-chloro-N-methyl-3-nitrobenzene-1-sulfonamide)
N-benzyl-4-chloro-N-methyl-3-nitrobenzene-1-sulfonamide is a specialized sulfonamide derivative featuring a benzyl group, chloro, nitro, and methyl substituents on a benzene ring. This compound is of interest in synthetic organic chemistry due to its versatile reactivity, particularly in the formation of sulfonamide-based intermediates. The presence of electron-withdrawing groups (chloro and nitro) enhances its utility in nucleophilic substitution reactions, while the N-benzyl and N-methyl moieties contribute to its solubility in organic solvents. Its structural complexity makes it a valuable building block for pharmaceuticals, agrochemicals, and materials science research. The compound is typically handled under controlled conditions due to its potential sensitivity to light and moisture.
62554-78-3 structure
Product Name:N-benzyl-4-chloro-N-methyl-3-nitrobenzene-1-sulfonamide
CAS No:62554-78-3
MF:C14H13ClN2O4S
MW:340.782021284103
CID:390611
PubChem ID:25624320
Update Time:2025-06-07
N-benzyl-4-chloro-N-methyl-3-nitrobenzene-1-sulfonamide Chemical and Physical Properties
Names and Identifiers
-
- Benzenesulfonamide, 4-chloro-N-methyl-3-nitro-N-(phenylmethyl)-
- N-benzyl-4-chloro-N-methyl-3-nitrobenzenesulfonamide
- N-benzyl-4-chloro-N-methyl-3-nitrobenzene-1-sulfonamide
- 62554-78-3
- AKOS030585615
- DTXSID00649716
- EN300-1131649
- Z26131508
-
- Inchi： 1S/C14H13ClN2O4S/c1-16(10-11-5-3-2-4-6-11)22(20,21)12-7-8-13(15)14(9-12)17(18)19/h2-9H,10H2,1H3
- InChI Key： QMHWQYACMHYRDW-UHFFFAOYSA-N
- SMILES： ClC1C=CC(=CC=1[N+](=O)[O-])S(N(C)CC1C=CC=CC=1)(=O)=O
Computed Properties
- Exact Mass: 340.0284558g/mol
- Monoisotopic Mass: 340.0284558g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 22
- Rotatable Bond Count: 4
- Complexity: 482
- 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: 3
- Topological Polar Surface Area: 91.6?2
N-benzyl-4-chloro-N-methyl-3-nitrobenzene-1-sulfonamide Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| Enamine | EN300-1131649-0.05g |
N-benzyl-4-chloro-N-methyl-3-nitrobenzene-1-sulfonamide |
62554-78-3 | 90% | 0.05g |
$348.0 | 2023-10-26 | |
| Enamine | EN300-1131649-0.1g |
N-benzyl-4-chloro-N-methyl-3-nitrobenzene-1-sulfonamide |
62554-78-3 | 90% | 0.1g |
$364.0 | 2023-10-26 | |
| Enamine | EN300-1131649-0.25g |
N-benzyl-4-chloro-N-methyl-3-nitrobenzene-1-sulfonamide |
62554-78-3 | 90% | 0.25g |
$381.0 | 2023-10-26 | |
| Enamine | EN300-1131649-0.5g |
N-benzyl-4-chloro-N-methyl-3-nitrobenzene-1-sulfonamide |
62554-78-3 | 90% | 0.5g |
$397.0 | 2023-10-26 | |
| Enamine | EN300-1131649-1.0g |
N-benzyl-4-chloro-N-methyl-3-nitrobenzene-1-sulfonamide |
62554-78-3 | 1g |
$470.0 | 2023-06-09 | ||
| Enamine | EN300-1131649-2.5g |
N-benzyl-4-chloro-N-methyl-3-nitrobenzene-1-sulfonamide |
62554-78-3 | 90% | 2.5g |
$810.0 | 2023-10-26 | |
| Enamine | EN300-1131649-5.0g |
N-benzyl-4-chloro-N-methyl-3-nitrobenzene-1-sulfonamide |
62554-78-3 | 5g |
$1364.0 | 2023-06-09 | ||
| Enamine | EN300-1131649-10.0g |
N-benzyl-4-chloro-N-methyl-3-nitrobenzene-1-sulfonamide |
62554-78-3 | 10g |
$2024.0 | 2023-06-09 | ||
| Enamine | EN300-1131649-1g |
N-benzyl-4-chloro-N-methyl-3-nitrobenzene-1-sulfonamide |
62554-78-3 | 90% | 1g |
$414.0 | 2023-10-26 | |
| Enamine | EN300-1131649-5g |
N-benzyl-4-chloro-N-methyl-3-nitrobenzene-1-sulfonamide |
62554-78-3 | 90% | 5g |
$1199.0 | 2023-10-26 |
N-benzyl-4-chloro-N-methyl-3-nitrobenzene-1-sulfonamide Related Literature
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Norihito Fukui,Keisuke Fujimoto,Hideki Yorimitsu,Atsuhiro Osuka Dalton Trans., 2017,46, 13322-13341
-
Xing Zhao,Lu Bai,Rui-Ying Bao,Zheng-Ying Liu,Ming-Bo Yang,Wei Yang RSC Adv., 2017,7, 46297-46305
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Daniel Messmer,Stefan Salentinig,Jakob Heier Nanoscale, 2019,11, 6929-6938
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Weili Dai,Guangjun Wu,Michael Hunger Chem. Commun., 2015,51, 13779-13782
-
Partha Laskar,Christine Dufès Nanoscale Adv., 2021,3, 6007-6026
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