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4-(4-hydroxyphenyl)-4-azatetracyclo[5.3.2.0²,?.0?,¹?]dodec-11-ene-3,5-dione

4-(4-hydroxyphenyl)-4-azatetracyclo[5.3.2.0²,?.0?,¹?]dodec-11-ene-3,5-dione

Formula: C17H15NO3

SMILES: OC1=CC=C(C=C1)N1C(=O)C2C(C3C=CC2C2CC32)C1=O

IUPAC: 4-(4-hydroxyphenyl)-4-azatetracyclo[5.3.2.0²,?.0?,¹?]dodec-11-ene-3,5-dione

InChI: InChI=1/C17H15NO3/c19-9-3-1-8(2-4-9)18-16(20)14-10-5-6-11(13-7-12(10)13)15(14)17(18)21/h1-6,10-15,19H,7H2

Composition: C (72.58%), H (5.37%), N (4.98%), O (17.06%)

Molar Mass: 281.311

Atom Count: 36

Heavy Atom Count: 21

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 6
Exact Mass 281.105193347
Formal Charge 0
FSP3 0.41
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
InChIKey TUFXXXBQHJYADM-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 76.59
Topological Polar Surface Area 57.61
Polarizability 29.31
Ring Count 5
Rotatable Bond Count 1

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Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C17H15NO3 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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