Cas no 745070-61-5 (Propanamide,N,N',N''-1,3,5-benzenetriyltris[2,2-dimethyl-)
745070-61-5 structure
Product Name:Propanamide,N,N',N''-1,3,5-benzenetriyltris[2,2-dimethyl-
CAS No:745070-61-5
MF:C21H33N3O3
MW:375.505025625229
CID:560686
PubChem ID:53421640
Update Time:2025-04-19
Propanamide,N,N',N''-1,3,5-benzenetriyltris[2,2-dimethyl- Chemical and Physical Properties
Names and Identifiers
-
- 1,3,5-Tris(2,2-dimethylpropionylamino)benzene
- 1,3,5-TRIS(2,2-DIMETHYLPROPANAMIDO)BENZENE
- N-[3,5-bis(2,2-dimethylpropanoylamino)phenyl]-2,2-dimethylpropanamide
- CGX 386
- DTXSID6075437
- IRGACLEAR XT 386
- SCHEMBL23441
- Propanamide, N,N',N''-1,3,5-benzenetriyltris[2,2-dimethyl-
- Propanamide,N,N',N''-1,3,5-benzenetriyltris[2,2-dimethyl-
- NS00076893
- Q27284392
- UNII-N1YOS8E19Y
- Propanamide, N,N',N''-1,3,5-benzenetriyltris(2,2-dimethyl-
- N,N',N''-1,3,5-BENZENETRIYLTRIS(2,2-DI-METHYLPROPANAMIDE)
- N,N',N-1,3,5-BENZENETRIYLTRIS(2,2-DIMETHYLPROPANAMIDE)
- 745070-61-5
- N1YOS8E19Y
- CPEULHAPWXMDDV-UHFFFAOYSA-N
- DB-301017
-
- Inchi： 1S/C21H33N3O3/c1-19(2,3)16(25)22-13-10-14(23-17(26)20(4,5)6)12-15(11-13)24-18(27)21(7,8)9/h10-12H,1-9H3,(H,22,25)(H,23,26)(H,24,27)
- InChI Key： CPEULHAPWXMDDV-UHFFFAOYSA-N
- SMILES： O=C(C(C)(C)C)NC1C=C(C=C(C=1)NC(C(C)(C)C)=O)NC(C(C)(C)C)=O
Computed Properties
- Exact Mass: 375.25219192g/mol
- Monoisotopic Mass: 375.25219192g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 3
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 27
- Rotatable Bond Count: 6
- Complexity: 472
- 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
- Surface Charge: 0
- Tautomer Count: 4
- XLogP3: 3.7
- Topological Polar Surface Area: 87.3?2
Propanamide,N,N',N''-1,3,5-benzenetriyltris[2,2-dimethyl- Related Literature
-
Denis V. Korchagin,Elena A. Yureva,Alexander V. Akimov,Eugenii Ya. Misochko,Gennady V. Shilov,Artem D. Talantsev,Roman B. Morgunov,Alexander A. Shakin,Sergey M. Aldoshin,Boris S. Tsukerblat Dalton Trans., 2017,46, 7540-7548
-
Matthew J. Gaunt,Jinquan Yu,Jonathan B. Spencer Chem. Commun., 2001, 1844-1845
-
Daniel Messmer,Stefan Salentinig,Jakob Heier Nanoscale, 2019,11, 6929-6938
-
Joseph W. Bennett,Diamond T. Jones,Blake G. Hudson,Joshua Melendez-Rivera,Robert J. Hamers,Sara E. Mason Environ. Sci.: Nano, 2020,7, 1642-1651
-
Marcin Czapla,Jack Simons Phys. Chem. Chem. Phys., 2018,20, 21739-21745
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