None
AlkaPlorer ID: AK318456
Synonym: None
IUPAC Name: (7,7-dimethyl-2-aza-7-azoniatricyclo[6.3.1.04,12]dodeca-1(12),3,8,10-tetraen-9-yl) hydrogen sulfite
Structure
SMILES: C[N+]1(C)CCC2=CNC3=CC=C(OS(=O)O)C1=C23
InChI: InChI=1S/C12H14N2O3S/c1-14(2)6-5-8-7-13-9-3-4-10(17-18(15)16)12(14)11(8)9/h3-4,7,13H,5-6H2,1-2H3/p+1
InChIKey: XFIMEMVNMWDPRW-UHFFFAOYSA-O
Source
Properties Information
Molecule Weight: 267.33
TPSA？: 62.32000000000001
MolLogP？: 1.8064
Number of H-Donors: 2
Number of H-Acceptors: 2
RingCount: 3
Activities Information
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