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38594-30-8 | Benzoxazole, 2-[5-(3-pyridinyl)-2-furanyl]-
CAS No: 38594-30-8 Catalog No: AG00791E MDL No:
Product Description
Catalog Number:
AG00791E
Chemical Name:
Benzoxazole, 2-[5-(3-pyridinyl)-2-furanyl]-
CAS Number:
38594-30-8
Molecular Formula:
C16H10N2O2
Molecular Weight:
262.2628
IUPAC Name:
2-(5-pyridin-3-ylfuran-2-yl)-1,3-benzoxazole
InChI:
InChI=1S/C16H10N2O2/c1-2-6-14-12(5-1)18-16(20-14)15-8-7-13(19-15)11-4-3-9-17-10-11/h1-10H
InChI Key:
TTYJAAANRSHMEC-UHFFFAOYSA-N
SMILES:
c1ccc(cn1)c1ccc(o1)c1nc2c(o1)cccc2
Properties
Complexity:
338
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
262.074g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
262.268g/mol
Monoisotopic Mass:
262.074g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
52.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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