Cas no 39182-88-2 (Acetamide,N-(2,4-dimethyl-3-nitrophenyl)-)
39182-88-2 structure
Product Name:Acetamide,N-(2,4-dimethyl-3-nitrophenyl)-
CAS No:39182-88-2
MF:C10H12N2O3
MW:208.213882446289
CID:316691
PubChem ID:170166
Update Time:2025-04-19
Acetamide,N-(2,4-dimethyl-3-nitrophenyl)- Chemical and Physical Properties
Names and Identifiers
-
- Acetamide,N-(2,4-dimethyl-3-nitrophenyl)-
- N-(2,4-dimethyl-3-nitrophenyl)acetamide
- EINECS 254-334-9
- NS00030533
- 5BS5Y3MPH6
- AE-562/12222804
- 39182-88-2
- SCHEMBL10969677
- UNII-5BS5Y3MPH6
- DTXSID4068161
- Acetamide, N-(2,4-dimethyl-3-nitrophenyl)-
- N-{3-nitro-2,4-dimethylphenyl}acetamide
- Oprea1_787457
-
- Inchi： 1S/C10H12N2O3/c1-6-4-5-9(11-8(3)13)7(2)10(6)12(14)15/h4-5H,1-3H3,(H,11,13)
- InChI Key： UCPGMSZAKZKWRS-UHFFFAOYSA-N
- SMILES： [O-][N+](C1C(C)=CC=C(C=1C)NC(C)=O)=O
Computed Properties
- Exact Mass: 208.08486
- Monoisotopic Mass: 208.085
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 15
- Rotatable Bond Count: 1
- Complexity: 262
- 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: 1.7
- Topological Polar Surface Area: 74.9?2
Experimental Properties
- Density: 1.247
- Boiling Point: 350.4°Cat760mmHg
- Flash Point: 165.7°C
- Refractive Index: 1.595
- PSA: 72.24
Acetamide,N-(2,4-dimethyl-3-nitrophenyl)- Related Literature
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Raheleh Torabi,Hedayatollah Ghourchian,Massoud Amanlou Org. Biomol. Chem., 2016,14, 8141-8153
-
Li-Hua Gan,Rui Wu,Jian-Lei Tian,Patrick W. Fowler Phys. Chem. Chem. Phys., 2017,19, 419-425
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José M. Rivera,Mariana Martín-Hidalgo,Jean C. Rivera-Ríos Org. Biomol. Chem., 2012,10, 7562-7565
-
Haitao Li,Yu Pan,Zhizhi Wang,Shan Chen,Ruixin Guo,Jianqiu Chen RSC Adv., 2015,5, 100775-100782
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