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101741-01-9 | 1-Decanone, 1-(4-methoxyphenyl)-
CAS No: 101741-01-9 Catalog No: AG0005D8 MDL No:
Product Description
Catalog Number:
AG0005D8
Chemical Name:
1-Decanone, 1-(4-methoxyphenyl)-
CAS Number:
101741-01-9
Molecular Formula:
C17H26O2
Molecular Weight:
262.3871
IUPAC Name:
1-(4-methoxyphenyl)decan-1-one
InChI:
InChI=1S/C17H26O2/c1-3-4-5-6-7-8-9-10-17(18)15-11-13-16(19-2)14-12-15/h11-14H,3-10H2,1-2H3
InChI Key:
LAVLQQKHORTNFF-UHFFFAOYSA-N
SMILES:
CCCCCCCCCC(=O)c1ccc(cc1)OC
Properties
Complexity:
229
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
262.193g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
262.393g/mol
Monoisotopic Mass:
262.193g/mol
Rotatable Bond Count:
10
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.7
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