Text Search
Structure Search

4-(2-methoxyphenyl)-4-azatricyclo[5.2.2.0²,?]undec-8-ene-3,5-dione

4-(2-methoxyphenyl)-4-azatricyclo[5.2.2.0²,?]undec-8-ene-3,5-dione

Formula: C17H17NO3

SMILES: COC1=CC=CC=C1N1C(=O)C2C(C3CCC2C=C3)C1=O

IUPAC: 4-(2-methoxyphenyl)-4-azatricyclo[5.2.2.0²,?]undec-8-ene-3,5-dione

InChI: InChI=1/C17H17NO3/c1-21-13-5-3-2-4-12(13)18-16(19)14-10-6-7-11(9-8-10)15(14)17(18)20/h2-7,10-11,14-15H,8-9H2,1H3

Composition: C (72.07%), H (6.05%), N (4.94%), O (16.94%)

Molar Mass: 283.327

Atom Count: 38

Heavy Atom Count: 21

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 4
Exact Mass 283.120843411
Formal Charge 0
FSP3 0.41
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 0
InChIKey SXVZBQVWHUZROU-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 78.38
Topological Polar Surface Area 46.61
Polarizability 30.1
Ring Count 4
Rotatable Bond Count 2

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C17H17NO3 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
Request Quote