Basic information
- CAS
468091-82-9- Standard SMILES
C(=Nc1ccc(C2(c3ccc(N=Cc4cccs4)cc3)c3ccccc3-c3ccccc32)cc1)c1cccs1- InChIKey
JEMKDUSHYLLRDG-UHFFFAOYSA-N- Molecular formula
- C35H24N2S2
- Average molar mass
- 536.7 g/mol
Names & identifiers
- Preferred name
- 9,9-Bis[4-[(2-thienylmethylene)amino]phenyl]-9H-fluorene
- IUPAC
- 1-thiophen-2-yl-N-[4-[9-[4-(thiophen-2-ylmethylideneamino)phenyl]fluoren-9-yl]phenyl]methanimine
- English name
- (2-thienylmethylene)[4-(9-{4-[(2-thienylmethylene)amino]phenyl}-9H-fluoren-9-yl)phenyl]amine
- Molecular formula
- C35H24N2S2
- Molecular weight
- 536.71
Names & synonyms
9,9-Bis[4-[(2-thienylmethylene)amino]phenyl]-9H-fluoreneSTK047188AKOS0004917371-thiophen-2-yl-N-[4-[9-[4-(thiophen-2-ylmethylideneamino)phenyl]fluoren-9-yl]phenyl]methanimineST034574AN-329/408637884,4'-(9H-fluorene-9,9-diyl)bis{N-[(E)-thiophen-2-ylmethylidene]aniline}2-[(1E)-2-(4-{9-[4-((1E)-2-(2-thienyl)-1-azavinyl)phenyl]fluoren-9-yl}phenyl)- 2-azavinyl]thiopheneN-(2-thienylmethylene)-N-[4-(9-{4-[(2-thienylmethylene)amino]phenyl}-9H-fluoren-9-yl)phenyl]amineBenzenamine, 4,4'-(9H-fluoren-9-ylidene)bis[N-(2-thienylmethylene)- (9CI)(2-thienylmethylene)[4-(9-{4-[(2-thienylmethylene)amino]phenyl}-9H-fluoren-9-yl)phenyl]amine
Database identifiers
- CAS
468091-82-9- Nikkaji
- J3.202.053D
Properties
Computed structural properties
- XLogP
- 9.3
- Topological polar surface area
- 81.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 39
- Formal charge
- 0
- Complexity
- 785
Physicochemical properties
- Boiling point
- 685.9 · 685.9±55.0 °C(Predicted)
- Density
- 1.22 · 1.22±0.1 g/cm3(Predicted)
- pka
- 3.42 · 3.42±0.50(Predicted)
Chemistry & industry
Suppliers1 total
Alinda Chemical Ltd.+7 (495) 672-17-08 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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