Cas no 70034-25-2 (N~1~-(2,4-Dinitrophenyl)pentane-1,5-diamine)
70034-25-2 structure
Product Name:N~1~-(2,4-Dinitrophenyl)pentane-1,5-diamine
CAS No:70034-25-2
MF:C11H16N4O4
MW:268.269142150879
CID:2799508
PubChem ID:23110863
Update Time:2025-04-21
N~1~-(2,4-Dinitrophenyl)pentane-1,5-diamine Chemical and Physical Properties
Names and Identifiers
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- SCHEMBL2228171
- 70034-25-2
- N~1~-(2,4-Dinitrophenyl)pentane-1,5-diamine
- DTXCID70581396
- 2,4-dinitrophenylcadaverine
- DTXSID00630644
-
- Inchi： 1S/C11H16N4O4/c12-6-2-1-3-7-13-10-5-4-9(14(16)17)8-11(10)15(18)19/h4-5,8,13H,1-3,6-7,12H2
- InChI Key： LFIIKXKNSBXAKV-UHFFFAOYSA-N
- SMILES： [O-][N+](C1C=C(C=CC=1NCCCCCN)[N+](=O)[O-])=O
Computed Properties
- Exact Mass: 268.11715500Da
- Monoisotopic Mass: 268.11715500Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 6
- Heavy Atom Count: 19
- Rotatable Bond Count: 6
- Complexity: 302
- 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: 2.3
- Topological Polar Surface Area: 130?2
N~1~-(2,4-Dinitrophenyl)pentane-1,5-diamine Related Literature
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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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Max Attwood,Hiroki Akutsu,Lee Martin,Toby J. Blundell,Pierre Le Maguere,Scott S. Turner Dalton Trans., 2021,50, 11843-11851
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Min Kim,Jae-Joon Lee,Tengling Ye,Panagiotis E. Keivanidis,Kilwon Cho J. Mater. Chem. C, 2020,8, 1686-1696
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Kay S. McMillan,Anthony G. McCluskey,Annette Sorensen,Marie Boyd,Michele Zagnoni Analyst, 2016,141, 100-110
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Christopher J. Harrison,Kyle J. Berean,Enrico Della Gaspera,Jian Zhen Ou,Richard B. Kaner,Kourosh Kalantar-zadeh,Torben Daeneke Nanoscale, 2016,8, 16276-16283
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