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2-(1-benzothiophen-2-yl)-4-ethyl-4,5-dihydro-1,3-oxazole

2-(1-benzothiophen-2-yl)-4-ethyl-4,5-dihydro-1,3-oxazole

Formula: C13H13NOS

SMILES: CCC1COC(=N1)C1=CC2=CC=CC=C2S1

IUPAC: 2-(1-benzothiophen-2-yl)-4-ethyl-4,5-dihydro-1,3-oxazole

InChI: InChI=1/C13H13NOS/c1-2-10-8-15-13(14-10)12-7-9-5-3-4-6-11(9)16-12/h3-7,10H,2,8H2,1H3

Composition: C (67.50%), H (5.67%), N (6.06%), O (6.92%), S (13.86%)

Molar Mass: 231.31

Atom Count: 29

Heavy Atom Count: 16

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 1
Exact Mass 231.071785217
Formal Charge 0
FSP3 0.31
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 0
InChIKey FBWQTVDQCGDZHF-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 65.4
Topological Polar Surface Area 21.59
Polarizability 26.4
Ring Count 3
Rotatable Bond Count 2

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Molecule Market Select
Purity LeadTime Formula UnitPrice
98% <10 Days C13H13NOS Quote Only
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