Cas no 5873-80-3 (1-(3,5-dimethoxybenzyl)-4-(3,4,5-trimethoxybenzyl)piperazine)
5873-80-3 structure
Product Name:1-(3,5-dimethoxybenzyl)-4-(3,4,5-trimethoxybenzyl)piperazine
CAS No:5873-80-3
MF:C23H32N2O5
MW:416.510586738586
CID:1611871
PubChem ID:2874283
Update Time:2025-04-21
1-(3,5-dimethoxybenzyl)-4-(3,4,5-trimethoxybenzyl)piperazine Chemical and Physical Properties
Names and Identifiers
-
- 1-(3,5-dimethoxybenzyl)-4-(3,4,5-trimethoxybenzyl)piperazine
- 1-(3,5-Dimethoxy-benzyl)-4-(3,4,5-trimethoxy-benzyl)-piperazine
- piperazine, 1-[(3,5-dimethoxyphenyl)methyl]-4-[(3,4,5-trimethoxyphenyl)methyl]-
- 1-[(3,5-dimethoxyphenyl)methyl]-4-[(3,4,5-trimethoxyphenyl)methyl]piperazine
- DTXSID00386851
- 5873-80-3
- Cambridge id 5873803
- AB00099973-01
- STK145350
- AKOS000554181
-
- Inchi： 1S/C23H32N2O5/c1-26-19-10-17(11-20(14-19)27-2)15-24-6-8-25(9-7-24)16-18-12-21(28-3)23(30-5)22(13-18)29-4/h10-14H,6-9,15-16H2,1-5H3
- InChI Key： RYHRLYOCSJTKNG-UHFFFAOYSA-N
- SMILES： O(C)C1C(=C(C=C(C=1)CN1CCN(CC2C=C(C=C(C=2)OC)OC)CC1)OC)OC
Computed Properties
- Exact Mass: 416.23126
- Monoisotopic Mass: 416.231
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 7
- Heavy Atom Count: 30
- Rotatable Bond Count: 9
- Complexity: 462
- 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: 2.9
- Topological Polar Surface Area: 52.6?2
Experimental Properties
- Density: 1.14
- Boiling Point: 527.4°C at 760 mmHg
- Flash Point: 143.8°C
- Refractive Index: 1.555
- PSA: 52.63
1-(3,5-dimethoxybenzyl)-4-(3,4,5-trimethoxybenzyl)piperazine Related Literature
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Bo Cao,Yin Wei Chem. Commun., 2018,54, 2870-2873
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Andre Prates Pereira,Tao Dong,Eric P. Knoshaug,Nick Nagle,Ryan Spiller,Bonnie Panczak,Christopher J. Chuck,Philip T. Pienkos Sustainable Energy Fuels, 2020,4, 3400-3408
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Juan J. Sánchez,Miguel López-Haro,Juan C. Hernández-Garrido,Ginesa Blanco,Miguel A. Cauqui,José M. Rodríguez-Izquierdo,José A. Pérez-Omil,José J. Calvino,María P. Yeste J. Mater. Chem. A, 2019,7, 8993-9003
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Xixi Li,Nanwei Zhu,Ruohan Li,Qinpu Zhang Anal. Methods, 2020,12, 3376-3381
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