Cas no 62622-62-2 (Acetamide, N-(3,4,5-trimethyl-2-nitrophenyl)-)
62622-62-2 structure
Product Name:Acetamide, N-(3,4,5-trimethyl-2-nitrophenyl)-
CAS No:62622-62-2
MF:C11H14N2O3
MW:222.240462779999
CID:437616
PubChem ID:12346655
Update Time:2025-04-19
Acetamide, N-(3,4,5-trimethyl-2-nitrophenyl)- Chemical and Physical Properties
Names and Identifiers
-
- Acetamide, N-(3,4,5-trimethyl-2-nitrophenyl)-
- N-(3,4,5-trimethyl-2-nitrophenyl)acetamide
- DTXSID10492811
- 62622-62-2
-
- Inchi： 1S/C11H14N2O3/c1-6-5-10(12-9(4)14)11(13(15)16)8(3)7(6)2/h5H,1-4H3,(H,12,14)
- InChI Key： UPVSDJUJBWKFLS-UHFFFAOYSA-N
- SMILES： [O-][N+](C1=C(C=C(C)C(C)=C1C)NC(C)=O)=O
Computed Properties
- Exact Mass: 222.10052
- Monoisotopic Mass: 222.10044231g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 16
- Rotatable Bond Count: 1
- Complexity: 287
- 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: 2.6
- Topological Polar Surface Area: 74.9?2
Experimental Properties
- PSA: 72.24
Acetamide, N-(3,4,5-trimethyl-2-nitrophenyl)- Related Literature
-
Xiaofeng Lin RSC Adv., 2016,6, 9002-9006
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Eunhak Lim,Jiyoung Heo,Seong Keun Kim Nanoscale, 2019,11, 11369-11378
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