Cas no 50789-46-3 (N-methyl-3-phenoxybenzamide)
N-methyl-3-phenoxybenzamide structure
Product Name:N-methyl-3-phenoxybenzamide
CAS No:50789-46-3
MF:C14H13NO2
MW:227.258523702621
CID:1569380
PubChem ID:94538
Update Time:2025-04-21
N-methyl-3-phenoxybenzamide Chemical and Physical Properties
Names and Identifiers
-
- N-methyl-3-phenoxybenzamide
- benzamide, N-methyl-3-phenoxy-
- STL504414
- SCHEMBL7053844
- HMS1605O22
- AKOS003362693
- Z30272306
- 50789-46-3
- DTXSID40877475
-
- Inchi： 1S/C14H13NO2/c1-15-14(16)11-6-5-9-13(10-11)17-12-7-3-2-4-8-12/h2-10H,1H3,(H,15,16)
- InChI Key： FKCUOISXAGPXMY-UHFFFAOYSA-N
- SMILES： O(C1C=CC=CC=1)C1=CC=CC(C(NC)=O)=C1
Computed Properties
- Exact Mass: 227.09469
- Monoisotopic Mass: 227.094628657g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 17
- Rotatable Bond Count: 3
- Complexity: 249
- 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: 3.7
- Topological Polar Surface Area: 38.3?2
Experimental Properties
- PSA: 38.33
N-methyl-3-phenoxybenzamide Related Literature
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Vishwesh Venkatraman,Marco Foscato,Vidar R. Jensen,Bj?rn K?re Alsberg J. Mater. Chem. A, 2015,3, 9851-9860
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Gaurav J. Shah,Eric P.-Y. Chiou,Ming C. Wu,Chang-Jin “CJ” Kim Lab Chip, 2009,9, 1732-1739
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Olga Guselnikova,Gérard Audran,Jean-Patrick Joly,Andrii Trelin,Evgeny V. Tretyakov,Vaclav Svorcik,Oleksiy Lyutakov,Sylvain R. A. Marque Chem. Sci., 2021,12, 4154-4161
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Yi Cao,Yujiao Xiahou,Lixiang Xing,Xiang Zhang,Hong Li,ChenShou Wu,Haibing Xia Nanoscale, 2020,12, 20456-20466
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Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
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