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210836-32-1 | 3(2H)-Isoxazolone,5-(2-furanyl)-4-methyl-(9CI)
CAS No: 210836-32-1 Catalog No: AG00BTEH MDL No:
Product Description
Catalog Number:
AG00BTEH
Chemical Name:
3(2H)-Isoxazolone,5-(2-furanyl)-4-methyl-(9CI)
CAS Number:
210836-32-1
IUPAC Name:
5-(furan-2-yl)-4-methyl-1,2-oxazol-3-one
InChI:
InChI=1S/C8H7NO3/c1-5-7(12-9-8(5)10)6-3-2-4-11-6/h2-4H,1H3,(H,9,10)
InChI Key:
LYESODVARGIZAN-UHFFFAOYSA-N
Properties
Complexity:
247
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
165.043g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
165.148g/mol
Monoisotopic Mass:
165.043g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
51.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
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