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136366-90-0 | Ethanone, 1-[4-(1-methylethyl)phenyl]-2,2-dipropoxy-
CAS No: 136366-90-0 Catalog No: AG0011SK MDL No:
Product Description
Catalog Number:
AG0011SK
Chemical Name:
Ethanone, 1-[4-(1-methylethyl)phenyl]-2,2-dipropoxy-
CAS Number:
136366-90-0
Molecular Formula:
C17H26O3
Molecular Weight:
278.3865
IUPAC Name:
1-(4-propan-2-ylphenyl)-2,2-dipropoxyethanone
InChI:
InChI=1S/C17H26O3/c1-5-11-19-17(20-12-6-2)16(18)15-9-7-14(8-10-15)13(3)4/h7-10,13,17H,5-6,11-12H2,1-4H3
InChI Key:
DAVGJMOWNZHFNA-UHFFFAOYSA-N
SMILES:
CCCOC(C(=O)c1ccc(cc1)C(C)C)OCCC
Properties
Complexity:
259
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
278.188g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
278.392g/mol
Monoisotopic Mass:
278.188g/mol
Rotatable Bond Count:
9
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.4
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