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2-[(2H-1,3-benzodioxol-5-yloxy)methyl]-5-(thiophen-2-yl)-1,3,4-oxadiazole

2-[(2H-1,3-benzodioxol-5-yloxy)methyl]-5-(thiophen-2-yl)-1,3,4-oxadiazole

Formula: C14H10N2O4S

SMILES: C(OC1=CC2=C(OCO2)C=C1)C1=NN=C(O1)C1=CC=CS1

IUPAC: 2-[(2H-1,3-benzodioxol-5-yloxy)methyl]-5-(thiophen-2-yl)-1,3,4-oxadiazole

InChI: InChI=1S/C14H10N2O4S/c1-2-12(21-5-1)14-16-15-13(20-14)7-17-9-3-4-10-11(6-9)19-8-18-10/h1-6H,7-8H2

Composition: C (55.62%), H (3.33%), N (9.27%), O (21.17%), S (10.61%)

Molar Mass: 302.3

Atom Count: 31

Heavy Atom Count: 21

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 0
Exact Mass 302.036127984
Formal Charge 0
FSP3 0.14
Hetero Ring Count 3
Hydrogen Bond Acceptor Count 5
Hydrogen Bond Donor Count 0
InChIKey OYWLLJQPZPCDEH-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 85.14
Topological Polar Surface Area 66.61
Polarizability 29.05
Ring Count 4
Rotatable Bond Count 4

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Purity (%)
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Packet Size
Molecule Market Select
Purity LeadTime Formula UnitPrice
98% <10 Days C14H10N2O4S Quote Only