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1260783-70-7 | Ethanone, 1-(6-chloro-2-pyridinyl)-2-(3-methyl-5-isoxazolyl)-
CAS No: 1260783-70-7 Catalog No: AG000R8W MDL No:
Product Description
Catalog Number:
AG000R8W
Chemical Name:
Ethanone, 1-(6-chloro-2-pyridinyl)-2-(3-methyl-5-isoxazolyl)-
CAS Number:
1260783-70-7
Molecular Formula:
C11H9ClN2O2
Molecular Weight:
236.6544
IUPAC Name:
1-(6-chloropyridin-2-yl)-2-(3-methyl-1,2-oxazol-5-yl)ethanone
InChI:
InChI=1S/C11H9ClN2O2/c1-7-5-8(16-14-7)6-10(15)9-3-2-4-11(12)13-9/h2-5H,6H2,1H3
InChI Key:
KQXIGRBZZYMIPH-UHFFFAOYSA-N
SMILES:
Clc1cccc(n1)C(=O)Cc1onc(c1)C
Properties
Complexity:
262
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
236.035g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
236.655g/mol
Monoisotopic Mass:
236.035g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
56A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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