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149513-10-0 | 1-Propanone, 3-(dimethylamino)-1-[4-(dodecyloxy)phenyl]-
CAS No: 149513-10-0 Catalog No: AG001LS7 MDL No:
Product Description
Catalog Number:
AG001LS7
Chemical Name:
1-Propanone, 3-(dimethylamino)-1-[4-(dodecyloxy)phenyl]-
CAS Number:
149513-10-0
Molecular Formula:
C23H39NO2
Molecular Weight:
361.5613
IUPAC Name:
3-(dimethylamino)-1-(4-dodecoxyphenyl)propan-1-one
InChI:
InChI=1S/C23H39NO2/c1-4-5-6-7-8-9-10-11-12-13-20-26-22-16-14-21(15-17-22)23(25)18-19-24(2)3/h14-17H,4-13,18-20H2,1-3H3
InChI Key:
KGQUWJOHIRBTLS-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCCCOc1ccc(cc1)C(=O)CCN(C)C
Properties
Complexity:
335
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
361.298g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
361.57g/mol
Monoisotopic Mass:
361.298g/mol
Rotatable Bond Count:
16
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
7.1
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