Cas no 5434-53-7 (Propanamide,2-methyl-N-(3-nitrophenyl)-)
5434-53-7 structure
Product Name:Propanamide,2-methyl-N-(3-nitrophenyl)-
CAS No:5434-53-7
MF:C10H12N2O3
MW:208.213882446289
CID:382026
PubChem ID:225836
Update Time:2025-04-19
Propanamide,2-methyl-N-(3-nitrophenyl)- Chemical and Physical Properties
Names and Identifiers
-
- Propanamide,2-methyl-N-(3-nitrophenyl)-
- 2-methyl-N-(3-nitrophenyl)Propanamide
- 5,6-diamino-2-methyl-1H-pyrimidin-4-one
- 1-isopropylcarbonyloxy-3-m
- 3-Methylbut-2-enyl isobutyrate
- AC1L5A6Z
- AC1Q1NZK
- AG-H-05997
- CTK5E3250
- EINECS 278-516-2
- Isobuttersaeure-(3-methyl-but-2-enylester)
- Isobuttersaeure-(3-nitro-anilid)
- isobutyric acid-(3-methyl-but-2-enyl ester)
- isobutyric acid-(3-nitro-anilide)
- m-nitro-isobutyrylanilide
- N-(3'-nitro-phenyl)-isobutyramide
- N-Isobutyryl-m-nitroanilin
- Prenyl isobutyrate
- Propanoic acid, 2-methyl-, 3-methyl-2-butenyl ester
- AKOS000371221
- 5434-53-7
- 2-Methyl-N-(3-nitrophenyl)propanimidic acid
- Oprea1_395436
- YARNVNLKNTXUBT-UHFFFAOYSA-N
- NSC-15664
- FT-0721913
- NSC15664
- Propanamide, N-(3-nitrophenyl)-2-methyl-
- SCHEMBL3207627
- DTXSID60969422
-
- Inchi： 1S/C10H12N2O3/c1-7(2)10(13)11-8-4-3-5-9(6-8)12(14)15/h3-7H,1-2H3,(H,11,13)
- InChI Key： YARNVNLKNTXUBT-UHFFFAOYSA-N
- SMILES： O=C(C(C)C)NC1C=CC=C(C=1)[N+](=O)[O-]
Computed Properties
- Exact Mass: 208.08486
- Monoisotopic Mass: 208.08479225g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 15
- Rotatable Bond Count: 2
- Complexity: 248
- 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: 74.9?2
Experimental Properties
- PSA: 72.24
- LogP: 2.78550
Propanamide,2-methyl-N-(3-nitrophenyl)- Related Literature
-
Ivor Lon?ari? Phys. Chem. Chem. Phys., 2015,17, 9436-9445
-
Domenico Lombardo,Gianmarco Munaò,Pietro Calandra,Luigi Pasqua,Maria Teresa Caccamo Phys. Chem. Chem. Phys., 2019,21, 11983-11991
-
Marcin Czapla,Jack Simons Phys. Chem. Chem. Phys., 2018,20, 21739-21745
-
Alexandre Vimont,Arnaud Travert,Philippe Bazin,Jean-Claude Lavalley,Marco Daturi,Christian Serre,Gérard Férey,Sandrine Bourrelly,Philip L. Llewellyn Chem. Commun., 2007, 3291-3293
-
Kay S. McMillan,Anthony G. McCluskey,Annette Sorensen,Marie Boyd,Michele Zagnoni Analyst, 2016,141, 100-110
5434-53-7 (Propanamide,2-methyl-N-(3-nitrophenyl)-) Related Products
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- 1270529-38-8(1,2,3,4,5,6-Hexahydro-[2,3]bipyridinyl-6-ol)
- 2680771-01-9(4-cyclopentyl-3-{(prop-2-en-1-yloxy)carbonylamino}butanoic acid)
- 2098070-20-1(2-(3-(Pyridin-3-yl)-1H-pyrazol-1-yl)acetimidamide)
- 1444113-98-7(N-(3-cyanothiolan-3-yl)-2-[(2,2,2-trifluoroethyl)sulfanyl]pyridine-4-carboxamide)
- 941977-17-9(N'-(3-chloro-2-methylphenyl)-N-2-(dimethylamino)-2-(naphthalen-1-yl)ethylethanediamide)
- 2138166-62-6(2,2-Difluoro-3-[methyl(2-methylbutyl)amino]propanoic acid)
- 89640-58-4(2-Iodo-4-nitrophenylhydrazine)
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