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89421-99-8 | 1-Propanone, 1-(4-dodecyl-1-naphthalenyl)-
CAS No: 89421-99-8 Catalog No: AG0044T0 MDL No:
Product Description
Catalog Number:
AG0044T0
Chemical Name:
1-Propanone, 1-(4-dodecyl-1-naphthalenyl)-
CAS Number:
89421-99-8
Molecular Formula:
C25H36O
Molecular Weight:
352.5527
IUPAC Name:
1-(4-dodecylnaphthalen-1-yl)propan-1-one
InChI:
InChI=1S/C25H36O/c1-3-5-6-7-8-9-10-11-12-13-16-21-19-20-24(25(26)4-2)23-18-15-14-17-22(21)23/h14-15,17-20H,3-13,16H2,1-2H3
InChI Key:
WXJZPOXTTCENPW-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCCCc1ccc(c2c1cccc2)C(=O)CC
Properties
Complexity:
374
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
352.277g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
352.562g/mol
Monoisotopic Mass:
352.277g/mol
Rotatable Bond Count:
13
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
9.5
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