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143006-81-9 | Isoxazole, 4-butyl-3-methoxy-5-methyl- (9CI)
CAS No: 143006-81-9 Catalog No: AG00AIJ8 MDL No:
Product Description
Catalog Number:
AG00AIJ8
Chemical Name:
Isoxazole, 4-butyl-3-methoxy-5-methyl- (9CI)
CAS Number:
143006-81-9
IUPAC Name:
4-butyl-3-methoxy-5-methyl-1,2-oxazole
InChI:
InChI=1S/C9H15NO2/c1-4-5-6-8-7(2)12-10-9(8)11-3/h4-6H2,1-3H3
InChI Key:
DYTWQGUKIQSAQE-UHFFFAOYSA-N
Properties
Complexity:
130
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
169.11g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
169.224g/mol
Monoisotopic Mass:
169.11g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
35.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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