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84028-03-5 | Oxazole, 2-butyl-4-ethyl-5-methyl-
CAS No: 84028-03-5 Catalog No: AG0051R2 MDL No:
Product Description
Catalog Number:
AG0051R2
Chemical Name:
Oxazole, 2-butyl-4-ethyl-5-methyl-
CAS Number:
84028-03-5
Molecular Formula:
C10H17NO
Molecular Weight:
167.2481
IUPAC Name:
2-butyl-4-ethyl-5-methyl-1,3-oxazole
InChI:
InChI=1S/C10H17NO/c1-4-6-7-10-11-9(5-2)8(3)12-10/h4-7H2,1-3H3
InChI Key:
PGYVZKVDXNIABS-UHFFFAOYSA-N
SMILES:
CCCCc1oc(c(n1)CC)C
Properties
Complexity:
127
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
167.131g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
167.252g/mol
Monoisotopic Mass:
167.131g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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