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263897-90-1 | Ethanone, 1-[2-(5-methyl-3-isoxazolyl)-4-thiazolyl]-
CAS No: 263897-90-1 Catalog No: AG002SZO MDL No:MFCD00728589
Product Description
Catalog Number:
AG002SZO
Chemical Name:
Ethanone, 1-[2-(5-methyl-3-isoxazolyl)-4-thiazolyl]-
CAS Number:
263897-90-1
Molecular Formula:
C9H8N2O2S
Molecular Weight:
208.2370
MDL Number:
MFCD00728589
IUPAC Name:
1-[2-(5-methyl-1,2-oxazol-3-yl)-1,3-thiazol-4-yl]ethanone
InChI:
InChI=1S/C9H8N2O2S/c1-5-3-7(11-13-5)9-10-8(4-14-9)6(2)12/h3-4H,1-2H3
InChI Key:
VBJKUYDRCXPWKB-UHFFFAOYSA-N
SMILES:
Cc1onc(c1)c1scc(n1)C(=O)C
Properties
Complexity:
237
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
208.031g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
208.235g/mol
Monoisotopic Mass:
208.031g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
84.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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