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Home > Imidazoles > 88700-36-1
88700-36-1 | 4H-Imidazol-4-one, 2-butoxy-5-ethyl-3,5-dihydro-3-methyl-5-phenyl-
CAS No: 88700-36-1 Catalog No: AG0046EE MDL No:
Product Description
Catalog Number:
AG0046EE
Chemical Name:
4H-Imidazol-4-one, 2-butoxy-5-ethyl-3,5-dihydro-3-methyl-5-phenyl-
CAS Number:
88700-36-1
Molecular Formula:
C16H22N2O2
Molecular Weight:
274.3581
IUPAC Name:
2-butoxy-5-ethyl-3-methyl-5-phenylimidazol-4-one
InChI:
InChI=1S/C16H22N2O2/c1-4-6-12-20-15-17-16(5-2,14(19)18(15)3)13-10-8-7-9-11-13/h7-11H,4-6,12H2,1-3H3
InChI Key:
UHEODGBHPJTWBR-UHFFFAOYSA-N
SMILES:
CCCCOC1=NC(C(=O)N1C)(CC)c1ccccc1
Properties
Complexity:
375
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
274.168g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
274.364g/mol
Monoisotopic Mass:
274.168g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
41.9A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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