Cas no 32902-85-5 (Benzenamine, N-butyl-2,4,6-trinitro-)
32902-85-5 structure
Product Name:Benzenamine, N-butyl-2,4,6-trinitro-
CAS No:32902-85-5
MF:C10H12N4O6
MW:284.225481987
CID:2822306
Update Time:2023-08-07
Benzenamine, N-butyl-2,4,6-trinitro- Chemical and Physical Properties
Names and Identifiers
-
- Benzenamine, N-butyl-2,4,6-trinitro-
- N-Butyl-2,4,6-trinitrobenzenamine
- N-(2,4,6-trinitrophenyl)-butylamine
- Butyl(2,4,6-trinitrophenyl)amineanion
-
- Inchi： 1S/C10H12N4O6/c1-2-3-4-11-10-8(13(17)18)5-7(12(15)16)6-9(10)14(19)20/h5-6,11H,2-4H2,1H3
- InChI Key： LDTHUMAMJMEYMU-UHFFFAOYSA-N
- SMILES： [O-][N+](C1C=C(C=C(C=1NCCCC)[N+](=O)[O-])[N+](=O)[O-])=O
Computed Properties
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 7
- Heavy Atom Count: 20
- Rotatable Bond Count: 4
- Complexity: 349
- XLogP3: 3.2
- Topological Polar Surface Area: 150
Benzenamine, N-butyl-2,4,6-trinitro- Related Literature
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Nan Fu,Naphaporn Chiewchan,Xiao Dong Chen Food Funct., 2020,11, 211-220
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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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Maomao Hou,Fenglin Zhong,Qiu Jin,Enjiang Liu,Jie Feng,Tengyun Wang,Yue Gao RSC Adv., 2017,7, 34392-34400
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