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188920-58-3 | Methanone, (5-amino-3-methyl-4-isoxazolyl)-4-morpholinyl-
CAS No: 188920-58-3 Catalog No: AG002HIS MDL No:
Product Description
Catalog Number:
AG002HIS
Chemical Name:
Methanone, (5-amino-3-methyl-4-isoxazolyl)-4-morpholinyl-
CAS Number:
188920-58-3
Molecular Formula:
C9H13N3O3
Molecular Weight:
211.2178
IUPAC Name:
(5-amino-3-methyl-1,2-oxazol-4-yl)-morpholin-4-ylmethanone
InChI:
InChI=1S/C9H13N3O3/c1-6-7(8(10)15-11-6)9(13)12-2-4-14-5-3-12/h2-5,10H2,1H3
InChI Key:
DDYNDZMQWAWAIH-UHFFFAOYSA-N
SMILES:
O=C(c1c(N)onc1C)N1CCOCC1
Properties
Complexity:
243
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
211.096g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
211.221g/mol
Monoisotopic Mass:
211.096g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
81.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1
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