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65479-01-8 | 3-(2-Acetyloxyphenyl)isoxazole
CAS No: 65479-01-8 Catalog No: AG00EMO3 MDL No:
Product Description
Catalog Number:
AG00EMO3
Chemical Name:
3-(2-Acetyloxyphenyl)isoxazole
CAS Number:
65479-01-8
IUPAC Name:
[2-(1,2-oxazol-3-yl)phenyl] acetate
InChI:
InChI=1S/C11H9NO3/c1-8(13)15-11-5-3-2-4-9(11)10-6-7-14-12-10/h2-7H,1H3
InChI Key:
VSTOCZRNGGABNT-UHFFFAOYSA-N
Properties
Complexity:
232
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
203.058g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
203.197g/mol
Monoisotopic Mass:
203.058g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
52.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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