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1111638-48-2 | PyriMidine, 4-(4-isoxazolyl)-
CAS No: 1111638-48-2 Catalog No: AG0099G3 MDL No:
Product Description
Catalog Number:
AG0099G3
Chemical Name:
PyriMidine, 4-(4-isoxazolyl)-
CAS Number:
1111638-48-2
IUPAC Name:
4-pyrimidin-4-yl-1,2-oxazole
InChI:
InChI=1S/C7H5N3O/c1-2-8-5-9-7(1)6-3-10-11-4-6/h1-5H
InChI Key:
AGHADBNVBDMDBC-UHFFFAOYSA-N
Properties
Complexity:
131
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
147.043g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
147.137g/mol
Monoisotopic Mass:
147.043g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
51.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3
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