Cas no 5729-90-8 (4-(acetylamino)-N-[3-(dimethylamino)propyl]benzamide)
5729-90-8 structure
Product Name:4-(acetylamino)-N-[3-(dimethylamino)propyl]benzamide
CAS No:5729-90-8
MF:C14H21N3O2
MW:263.335443258286
CID:1604029
PubChem ID:2261892
Update Time:2025-04-21
4-(acetylamino)-N-[3-(dimethylamino)propyl]benzamide Chemical and Physical Properties
Names and Identifiers
-
- 4-(acetylamino)-N-[3-(dimethylamino)propyl]benzamide
- 4-Acetamido-N-[3-(dimethylamino)propyl]benzamide
- benzamide, 4-(acetylamino)-N-[3-(dimethylamino)propyl]-
- ST043129
- STK032458
- BIM-0029163.P001
- DTXSID60367368
- SR-01000218204-1
- SR-01000218204
- N-[3-(DIMETHYLAMINO)PROPYL]-4-ACETAMIDOBENZAMIDE
- CBMicro_029205
- 5729-90-8
- AKOS003277696
-
- Inchi: 1S/C14H21N3O2/c1-11(18)16-13-7-5-12(6-8-13)14(19)15-9-4-10-17(2)3/h5-8H,4,9-10H2,1-3H3,(H,15,19)(H,16,18)
- InChI Key: DQJMISBYHPSOCM-UHFFFAOYSA-N
- SMILES: O=C(C1C=CC(=CC=1)NC(C)=O)NCCCN(C)C
Computed Properties
- Exact Mass: 263.16353
- Monoisotopic Mass: 263.163
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 19
- Rotatable Bond Count: 6
- Complexity: 297
- 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: 0.4
- Topological Polar Surface Area: 61.4?2
Experimental Properties
- Density: 1.115
- Boiling Point: 495.9°C at 760 mmHg
- Flash Point: 253.7°C
- Refractive Index: 1.56
- PSA: 61.44
4-(acetylamino)-N-[3-(dimethylamino)propyl]benzamide Related Literature
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1. Excimer emission and magnetoluminescence of radical-based zinc(ii) complexes doped in host crystals?Shojiro Kimura,Tetsuro Kusamoto Chem. Commun., 2020,56, 11195-11198
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Thi Thu Tram Nguyen,Thanh Binh Nguyen Org. Biomol. Chem., 2021,19, 6015-6020
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Bin Han,Yasuo Shimizu,Gabriele Seguini,Celia Castro,Gérard Ben Assayag,Koji Inoue,Yasuyoshi Nagai,Sylvie Schamm-Chardon,Michele Perego RSC Adv., 2016,6, 3617-3622
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Dhirendra K. Chaudhary,Pramendra Kumar,Lokendra Kumar RSC Adv., 2016,6, 94731-94738
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M. Zeiger,N. J?ckel,P. Strubel,L. Borchardt,R. Reinhold,W. Nickel,J. Eckert,V. Presser,S. Kaskel J. Mater. Chem. A, 2015,3, 17983-17990
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