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1-(2H-1,3-benzodioxol-5-yl)-3-(1H-indol-3-yl)propan-1-one

1-(2H-1,3-benzodioxol-5-yl)-3-(1H-indol-3-yl)propan-1-one

Formula: C18H15NO3

SMILES: O=C(CCC1=CNC2=CC=CC=C12)C1=CC2=C(OCO2)C=C1

IUPAC: 1-(2H-1,3-benzodioxol-5-yl)-3-(1H-indol-3-yl)propan-1-one

InChI: InChI=1S/C18H15NO3/c20-16(12-6-8-17-18(9-12)22-11-21-17)7-5-13-10-19-15-4-2-1-3-14(13)15/h1-4,6,8-10,19H,5,7,11H2

Composition: C (73.71%), H (5.15%), N (4.78%), O (16.36%)

Molar Mass: 293.322

Atom Count: 37

Heavy Atom Count: 22

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 0
Exact Mass 293.105193347
Formal Charge 0
FSP3 0.17
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
InChIKey BDKIRHZPZKTKDB-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 82.64
Topological Polar Surface Area 51.32
Polarizability 33.17
Ring Count 4
Rotatable Bond Count 4

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Struchem co.,ltd
Purity LeadTime Formula PacketSize UnitPrice
95% <5 Days C18H15NO3 $1,301.00-$2,420.00$1,301.00$1,901.00$2,420.00
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