Text Search
Structure Search

3-oxa-13-azatetracyclo[7.7.1.0²,?.0¹³,¹?]heptadeca-1,5,7,9(17)-tetraen-4-one

3-oxa-13-azatetracyclo[7.7.1.0²,?.0¹³,¹?]heptadeca-1,5,7,9(17)-tetraen-4-one

CAS: 58336-35-9

Formula: C15H15NO2

SMILES: O=C1OC2=C3CCCN4CCCC(C=C2C=C1)=C34

IUPAC: 3-oxa-13-azatetracyclo[7.7.1.0²,?.0¹³,¹?]heptadeca-1,5,7,9(17)-tetraen-4-one

InChI: InChI=1S/C15H15NO2/c17-13-6-5-11-9-10-3-1-7-16-8-2-4-12(14(10)16)15(11)18-13/h5-6,9H,1-4,7-8H2

Composition: C (74.67%), H (6.27%), N (5.81%), O (13.26%)

Molar Mass: 241.29

Atom Count: 33

Heavy Atom Count: 18

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 241.110278727
Formal Charge 0
FSP3 0.4
Hetero Ring Count 3
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 0
InChIKey MZSOXGPKUOAXNY-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 71.8
Topological Polar Surface Area 29.54
Polarizability 26.19
Ring Count 4
Rotatable Bond Count 0

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
| Clear Filters
Molecule Market Select
Purity LeadTime CAS PacketSize UnitPrice
99.63% <7 Days 58336-35-9 $121.55-$392.70$121.55$205.70$392.70
Request Quote
Molecule Market Select
Purity LeadTime CAS UnitPrice
98% <14 Days 58336-35-9 Quote Only
Request Quote