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69299-47-4 | 5-(2,5-Dimethylphenyl)-3,4-dimethylisoxazole
CAS No: 69299-47-4 Catalog No: AG00FP92 MDL No:
Product Description
Catalog Number:
AG00FP92
Chemical Name:
5-(2,5-Dimethylphenyl)-3,4-dimethylisoxazole
CAS Number:
69299-47-4
IUPAC Name:
5-(2,5-dimethylphenyl)-3,4-dimethyl-1,2-oxazole
InChI:
InChI=1S/C13H15NO/c1-8-5-6-9(2)12(7-8)13-10(3)11(4)14-15-13/h5-7H,1-4H3
InChI Key:
OWZOHHSIMQFCKP-UHFFFAOYSA-N
Properties
Complexity:
219
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
201.115g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
201.269g/mol
Monoisotopic Mass:
201.115g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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