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605627-81-4 | Benzoxazole, 2-[1-(methylsulfonyl)-4-piperidinyl]- (9CI)
CAS No: 605627-81-4 Catalog No: AG00EOF2 MDL No:
Product Description
Catalog Number:
AG00EOF2
Chemical Name:
Benzoxazole, 2-[1-(methylsulfonyl)-4-piperidinyl]- (9CI)
CAS Number:
605627-81-4
IUPAC Name:
2-(1-methylsulfonylpiperidin-4-yl)-1,3-benzoxazole
InChI:
InChI=1S/C13H16N2O3S/c1-19(16,17)15-8-6-10(7-9-15)13-14-11-4-2-3-5-12(11)18-13/h2-5,10H,6-9H2,1H3
InChI Key:
UYJLJDZSHZPJAT-UHFFFAOYSA-N
Properties
Complexity:
412
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
280.088g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
280.342g/mol
Monoisotopic Mass:
280.088g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
71.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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