Cas no 218956-13-9 (1,4-Butanediamine, N,N'-bis[(4-methoxyphenyl)methyl]-)
![1,4-Butanediamine, N,N'-bis[(4-methoxyphenyl)methyl]- structure](https://ossimg.kuujia.com/scimg/219000/218956-13-9x500.png)
218956-13-9 structure
Product Name:1,4-Butanediamine, N,N'-bis[(4-methoxyphenyl)methyl]-
CAS No:218956-13-9
MF:C20H28N2O2
MW:328.448525428772
CID:1409315
PubChem ID:44458572
Update Time:2025-04-20
1,4-Butanediamine, N,N'-bis[(4-methoxyphenyl)methyl]- Chemical and Physical Properties
Names and Identifiers
-
- 1,4-Butanediamine, N,N'-bis[(4-methoxyphenyl)methyl]-
- N,N'-bis[(4-methoxyphenyl)methyl]butane-1,4-diamine
- SCHEMBL22839742
- CHEMBL23440
- N~1~,N~4~-Bis[(4-methoxyphenyl)methyl]butane-1,4-diamine
- 218956-13-9
- DTXSID70659180
-
- Inchi： 1S/C20H28N2O2/c1-23-19-9-5-17(6-10-19)15-21-13-3-4-14-22-16-18-7-11-20(24-2)12-8-18/h5-12,21-22H,3-4,13-16H2,1-2H3
- InChI Key： RLBUJFLNOYOSCZ-UHFFFAOYSA-N
- SMILES： O(C)C1C=CC(=CC=1)CNCCCCNCC1C=CC(=CC=1)OC
Computed Properties
- Exact Mass: 328.21524
- Monoisotopic Mass: 328.215
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 24
- Rotatable Bond Count: 11
- Complexity: 268
- 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
- Topological Polar Surface Area: 42.5A^2
- XLogP3: 3
Experimental Properties
- PSA: 42.52
1,4-Butanediamine, N,N'-bis[(4-methoxyphenyl)methyl]- Related Literature
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Chongyang Zhu,Xiaojia Bian,Xin Jia,Ning Tang,Yongqiang Cheng Food Funct., 2020,11, 10635-10644
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Xixi Li,Nanwei Zhu,Ruohan Li,Qinpu Zhang Anal. Methods, 2020,12, 3376-3381
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3. An autonomous self-optimizing flow machine for the synthesis of pyridine–oxazoline (PyOX) ligands?Eric Wimmer,Daniel Cortés-Borda,Solène Brochard,Elvina Barré,Charlotte Truchet,Fran?ois-Xavier Felpin React. Chem. Eng., 2019,4, 1608-1615
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Karl Crowley,Eimer O'Malley,Aoife Morrin,Malcolm R. Smyth,Anthony J. Killard Analyst, 2008,133, 391-399
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Jingquan Liu,Huiyun Liu,Zhongfan Jia,Volga Bulmus,Thomas P. Davis Chem. Commun., 2008, 6582-6584
218956-13-9 (1,4-Butanediamine, N,N'-bis[(4-methoxyphenyl)methyl]-) Related Products
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