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4,5,15,16-tetramethoxy-10,10-dimethyl-10-azatetracyclo[7.7.1.0²,?.0¹³,¹?]heptadeca-1(17),2(7),3,5,13,15-hexaen-10-ium

4,5,15,16-tetramethoxy-10,10-dimethyl-10-azatetracyclo[7.7.1.0²,?.0¹³,¹?]heptadeca-1(17),2(7),3,5,13,15-hexaen-10-ium

Formula: C22H28NO4

SMILES: COC1=CC2=C(C=C1OC)C1=C3C(C2)[N+](C)(C)CCC3=CC(OC)=C1OC

IUPAC: 4,5,15,16-tetramethoxy-10,10-dimethyl-10-azatetracyclo[7.7.1.0²,?.0¹³,¹?]heptadeca-1(17),2(7),3,5,13,15-hexaen-10-ium

InChI: InChI=1/C22H28NO4/c1-23(2)8-7-13-10-19(26-5)22(27-6)21-15-12-18(25-4)17(24-3)11-14(15)9-16(23)20(13)21/h10-12,16H,7-9H2,1-6H3/q+1

Composition: C (71.33%), H (7.62%), N (3.78%), O (17.27%)

Molar Mass: 370.468

Atom Count: 55

Heavy Atom Count: 27

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 1
Exact Mass 370.201284806
Formal Charge 1
FSP3 0.45
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 0
InChIKey WKHHFWJJIRCXHA-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 117.79
Topological Polar Surface Area 36.92
Polarizability 42.24
Ring Count 4
Rotatable Bond Count 4

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Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C22H28NO4 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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