Cas no 54766-66-4 (Acetamide, N-(5-acetyl-2-methylphenyl)-)
54766-66-4 structure
Product Name:Acetamide, N-(5-acetyl-2-methylphenyl)-
CAS No:54766-66-4
MF:C11H13NO2
MW:191.226423025131
CID:353734
PubChem ID:3702609
Update Time:2025-04-19
Acetamide, N-(5-acetyl-2-methylphenyl)- Chemical and Physical Properties
Names and Identifiers
-
- Acetamide, N-(5-acetyl-2-methylphenyl)-
- N-(5-acetyl-2-methylphenyl)acetamide
- SCHEMBL13100053
- AKOS022342797
- DTXSID30395254
- 54766-66-4
- 5'-ACETYL-2'-METHYLACETANILIDE
-
- Inchi： 1S/C11H13NO2/c1-7-4-5-10(8(2)13)6-11(7)12-9(3)14/h4-6H,1-3H3,(H,12,14)
- InChI Key： RDJDCGIJXKDWIR-UHFFFAOYSA-N
- SMILES： O=C(C)C1C=CC(C)=C(C=1)NC(C)=O
Computed Properties
- Exact Mass: 191.09469
- Monoisotopic Mass: 191.094628657g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 14
- Rotatable Bond Count: 2
- Complexity: 237
- 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: 0.9
- Topological Polar Surface Area: 46.2?2
Experimental Properties
- PSA: 46.17
Acetamide, N-(5-acetyl-2-methylphenyl)- Related Literature
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Bidou Wang,Xifeng Chen Analyst, 2014,139, 5695-5699
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Inês S. Albuquerque,Hélia F. Jeremias,Miguel Chaves-Ferreira,Dijana Matak-Vinkovic,Omar Boutureira,Carlos C. Rom?o Chem. Commun., 2015,51, 3993-3996
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Kanjun Sun,Fengting Hua,Shuzhen Cui,Yanrong Zhu,Hui Peng,Guofu Ma RSC Adv., 2021,11, 37631-37642
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Li-Hua Gan,Rui Wu,Jian-Lei Tian,Patrick W. Fowler Phys. Chem. Chem. Phys., 2017,19, 419-425
54766-66-4 (Acetamide, N-(5-acetyl-2-methylphenyl)-) Related Products
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