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| Name |
N3,N3,N6,N6-Tetrakis[4-(dibutylamino)phenyl]-1,4-cyclohexadiene-3,6-diaminium hexafluoroantimonate (1:2) |
EINECS | 226-831-0 |
| CAS No. | 5496-71-9 | Density | N/A |
| PSA | 21.84000 | LogP | 20.71500 |
| Solubility | N/A | Melting Point |
200-210°C |
| Formula | C62H92F12N6Sb2 | Boiling Point | N/A |
| Molecular Weight | 1120.35 | Flash Point | N/A |
| Transport Information | N/A | Appearance | N/A |
| Safety | 22-24/25 | Risk Codes | N/A |
| Molecular Structure |
|
Hazard Symbols | N/A |
| Synonyms |
Cyasorb IR 165;Benzenaminium,N,N'-2,5-cyclohexadiene-1,4- diylidenebis[4-(dibutylamino)-N-[4- (dibutylamino)phenyl]-,bis[(OC-6-11)- hexafluoroantimonate(1-)];N,N,N,N-Tetrakis(4-dibutylaminophenyl)-p-benzoquinone; |
N3,N3,N6,N6-Tetrakis[4-(dibutylamino)phenyl]-1,4-cyclohexadiene-3,6-diaminium hexafluoroantimonate (1:2) Specification
The N3,N3,N6,N6-Tetrakis[4-(dibutylamino)phenyl]-1,4-cyclohexadiene-3,6-diaminium hexafluoroantimonate (1:2), with the cas registry number of 5496-71-9, is also known as N,N'-Cyclohexa-2,5-diene-1,4-diylidenebis[4-(dibutylamino)-N-[4-(dibutylamino)phenyl]anilinium] bis[hexafluoroantimonate(1-)](1:2). Its EINECS number is 226-831-0. What's more, both its IUPAC name and systematic name are the same which is called Antimony; dibutyl-[4-[[4-[4-(dibutylamino)-N-[4-(dibutylamino)phenyl]anilino]phenyl]-[4-(dibutylamino)phenyl]azaniumylidene]cyclohexa-2,5-dien-1-ylidene]azanium; dodecafluoride.
Physical properties about this chemical are: (1)#H bond acceptors: 6; (2)#H bond donors: 0; (3)Rotatable Bond Count: 32; (4)Exact Mass: 1392.527219; (5)MonoIsotopic Mass: 1390.526821; (6)Topological Polar Surface Area: 19; (7)Heavy Atom Count: 82; (8)Formal Charge: -10; (9)Complexity: 1190; (10)Melting Point: 200-210°C.
You can still convert the following datas into molecular structure:
(1)Canonical SMILES: CCCCN(CCCC)C1=CC=C(C=C1)N(C2=CC=C(C=C2)N(CCCC)CCCC)C3=CC=C(C=C3)[N+](=C4C=CC(=[N+](CCCC)CCCC)C=C4)C5=CC=C(C=C5)N(CCCC)CCCC.[F-].[F-].[F-].[F-].[F-].[F-].[F-].[F-].[F-].[F-].[F-].[F-].[Sb].[Sb]
(2)InChI: InChI=1S/C62H92N6.12FH.2Sb/c1-9-17-45-63(46-18-10-2)53-25-33-57(34-26-53)67(58-35-27-54(28-36-58)64(47-19-11-3)48-20-12-4)61-41-43-62(44-42-61)68(59-37-29-55(30-38-59)65(49-21-13-5)50-22-14-6)60-39-31-56(32-40-60)66(51-23-15-7)52-24-16-8;;;;;;;;;;;;;;/h25-44H,9-24,45-52H2,1-8H3;12*1H;;/q+2;;;;;;;;;;;;;;/p-12
(3)InChIKey: PVPPMBMDSDLVQN-UHFFFAOYSA-B
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