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60031-48-3 | Isoxazole, 4-ethyl- (6CI,7CI,9CI)
CAS No: 60031-48-3 Catalog No: AG00EZFX MDL No:
Product Description
Catalog Number:
AG00EZFX
Chemical Name:
Isoxazole, 4-ethyl- (6CI,7CI,9CI)
CAS Number:
60031-48-3
IUPAC Name:
4-ethyl-1,2-oxazole
InChI:
InChI=1S/C5H7NO/c1-2-5-3-6-7-4-5/h3-4H,2H2,1H3
InChI Key:
UUDFJRNNVALHDT-UHFFFAOYSA-N
Properties
Complexity:
56
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
97.053g/mol
Formal Charge:
0
Heavy Atom Count:
7
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
97.117g/mol
Monoisotopic Mass:
97.053g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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