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Home > Fluorides > 833462-34-3
833462-34-3 | Isoxazole, 3-(4-fluorophenyl)-5-[(phenylseleno)methyl]-
CAS No: 833462-34-3 Catalog No: AG004W8E MDL No:
Product Description
Catalog Number:
AG004W8E
Chemical Name:
Isoxazole, 3-(4-fluorophenyl)-5-[(phenylseleno)methyl]-
CAS Number:
833462-34-3
Molecular Formula:
C16H12FNOSe
Molecular Weight:
332.2310
IUPAC Name:
3-(4-fluorophenyl)-5-(phenylselanylmethyl)-1,2-oxazole
InChI:
InChI=1S/C16H12FNOSe/c17-13-8-6-12(7-9-13)16-10-14(19-18-16)11-20-15-4-2-1-3-5-15/h1-10H,11H2
InChI Key:
XLOGDRAPECYOKJ-UHFFFAOYSA-N
SMILES:
Fc1ccc(cc1)c1noc(c1)C[Se]c1ccccc1
Properties
Complexity:
290
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
333.007g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
332.247g/mol
Monoisotopic Mass:
333.007g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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