Cas no 133416-04-3 (4,8,12,16-Tetraazaeicosane-1,20-diamine)
133416-04-3 structure
Product Name:4,8,12,16-Tetraazaeicosane-1,20-diamine
CAS No:133416-04-3
MF:C16H40N6
MW:316.529003143311
CID:234791
PubChem ID:10018687
Update Time:2025-04-19
4,8,12,16-Tetraazaeicosane-1,20-diamine Chemical and Physical Properties
Names and Identifiers
-
- 4,8,12,16-Tetraazaeicosane-1,20-diamine
- Homocaldohexamine
- N'-[3-[3-[3-(3-aminopropylamino)propylamino]propylamino]propyl]butane-1,4-diamine
- 133416-04-3
- DTXSID90434310
- SCHEMBL3158875
-
- Inchi： 1S/C16H40N6/c17-7-1-2-9-19-11-4-13-21-15-6-16-22-14-5-12-20-10-3-8-18/h19-22H,1-18H2
- InChI Key： VJJWUYZASSXYHG-UHFFFAOYSA-N
- SMILES： N(CCCNCCCCN)CCCNCCCNCCCN
Computed Properties
- Exact Mass: 316.3318
- Monoisotopic Mass: 316.33144530g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 6
- Hydrogen Bond Acceptor Count: 6
- Heavy Atom Count: 22
- Rotatable Bond Count: 19
- Complexity: 192
- 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: -1.2
- Topological Polar Surface Area: 100?2
Experimental Properties
- PSA: 100.16
4,8,12,16-Tetraazaeicosane-1,20-diamine Related Literature
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Bidyut Kumar Kundu,Rinky Singh,Ritudhwaj Tiwari,Debasis Nayak New J. Chem., 2019,43, 4867-4877
-
Yang Xu,Min Wang,Donghui Wei,Rongqiang Tian,Zheng Duan,Fran?ois Mathey Dalton Trans., 2019,48, 5523-5526
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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
-
Luis Miguel Azofra,Douglas R. MacFarlane,Chenghua Sun Chem. Commun., 2016,52, 3548-3551
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Ravi Kumar Yadav,R. Govindaraj Phys. Chem. Chem. Phys., 2020,22, 26876-26886
133416-04-3 (4,8,12,16-Tetraazaeicosane-1,20-diamine) Related Products
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