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rel-N,N'-((1R,2S)-Cyclohexane-1,2-diyl)bis(1-(pyridin-2-yl)methanimine)

HCID 336578
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Basic information

CAS
90605-88-2
Standard SMILES
C(=N[C@H]1CCCC[C@H]1N=Cc1ccccn1)c1ccccn1
InChIKey
VYIMTYRAXWNXFU-HDICACEKSA-N
Molecular formula
C18H20N4
Average molar mass
292.4 g/mol
Monoisotopic mass
292.16879665

Names & identifiers

Preferred name
rel-N,N'-((1R,2S)-Cyclohexane-1,2-diyl)bis(1-(pyridin-2-yl)methanimine)
IUPAC
1-pyridin-2-yl-N-[(1S,2R)-2-(pyridin-2-ylmethylideneamino)cyclohexyl]methanimine

Names & synonyms

90605-88-2NSC351354rel-N,N'-((1R,2S)-Cyclohexane-1,2-diyl)bis(1-(pyridin-2-yl)methanimine)rel-(1E,1'E)-N,N'-((1R,2S)-Cyclohexane-1,2-diyl)bis(1-(pyridin-2-yl)methanimine)249643-53-6DTXSID30319859NSC-351354(E,E)-N,N'-[(1R,2S)-Cyclohexane-1,2-diyl]bis[1-(pyridin-2-yl)methanimine]

Database identifiers

CAS
90605-88-2
PubChem CID
336578
DTXSID
DTXSID30319859
Nikkaji
J1.198.656K

Properties

Computed structural properties

XLogP
2.6
Topological polar surface area
50.5 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
4
Heavy atoms
22
Formal charge
0
Complexity
343

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