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926194-68-5 | 2-(3,5-Dimethyl-isoxazol-4-ylmethoxy)-3-methyl-benzoic acid
CAS No: 926194-68-5 Catalog No: AG00IH86 MDL No:
Product Description
Catalog Number:
AG00IH86
Chemical Name:
2-(3,5-Dimethyl-isoxazol-4-ylmethoxy)-3-methyl-benzoic acid
CAS Number:
926194-68-5
IUPAC Name:
2-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-3-methylbenzoic acid
InChI:
InChI=1S/C14H15NO4/c1-8-5-4-6-11(14(16)17)13(8)18-7-12-9(2)15-19-10(12)3/h4-6H,7H2,1-3H3,(H,16,17)
InChI Key:
QODSHLNHPZQDFC-UHFFFAOYSA-N
Properties
Complexity:
323
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
261.1g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
261.277g/mol
Monoisotopic Mass:
261.1g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
72.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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