Cas no 89905-83-9 (1,1'-Bicyclohexyl, 4,4'-dinitro-)
89905-83-9 structure
Product Name:1,1'-Bicyclohexyl, 4,4'-dinitro-
CAS No:89905-83-9
MF:C12H20N2O4
MW:256.298203468323
CID:585491
PubChem ID:71326833
Update Time:2025-04-19
1,1'-Bicyclohexyl, 4,4'-dinitro- Chemical and Physical Properties
Names and Identifiers
-
- 1,1'-Bicyclohexyl, 4,4'-dinitro-
- 1-nitro-4-(4-nitrocyclohexyl)cyclohexane
- 4,4'-Dinitro-1,1'-bi(cyclohexane)
- 89905-83-9
- DTXSID80755965
-
- Inchi： 1S/C12H20N2O4/c15-13(16)11-5-1-9(2-6-11)10-3-7-12(8-4-10)14(17)18/h9-12H,1-8H2
- InChI Key： FPNGQGKZSOWYEA-UHFFFAOYSA-N
- SMILES： [O-][N+](C1CCC(CC1)C1CCC(CC1)[N+](=O)[O-])=O
Computed Properties
- Exact Mass: 256.14230712g/mol
- Monoisotopic Mass: 256.14230712g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 18
- Rotatable Bond Count: 1
- Complexity: 275
- 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: 2.8
- Topological Polar Surface Area: 91.6?2
1,1'-Bicyclohexyl, 4,4'-dinitro- Related Literature
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P. K. Wawrzyniak,M. T. P. Beerepoot,H. J. M. de Groot,F. Buda Phys. Chem. Chem. Phys., 2011,13, 10270-10279
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Adeline Huiling Loo,Alessandra Bonanni,Martin Pumera Analyst, 2013,138, 467-471
-
M. Sheykhan,S. Khani,S. Shaabanzadeh,M. Joafshan Green Chem., 2017,19, 5940-5948
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Suji Lee,Min Su Han Chem. Commun., 2021,57, 9450-9453
-
Hamid Heydari,Mohammad B. Gholivand New J. Chem., 2017,41, 237-244
89905-83-9 (1,1'-Bicyclohexyl, 4,4'-dinitro-) Related Products
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