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951885-89-5 | Ethyl 7-[3-(N,N-Dimethylamino)phenyl]-7-oxoheptanoate
CAS No: 951885-89-5 Catalog No: AG01F8DK MDL No:
Product Description
Catalog Number:
AG01F8DK
Chemical Name:
Ethyl 7-[3-(N,N-Dimethylamino)phenyl]-7-oxoheptanoate
CAS Number:
951885-89-5
Molecular Formula:
C17H25NO3
Molecular Weight:
291.3853
IUPAC Name:
ethyl 7-[3-(dimethylamino)phenyl]-7-oxoheptanoate
InChI:
InChI=1S/C17H25NO3/c1-4-21-17(20)12-7-5-6-11-16(19)14-9-8-10-15(13-14)18(2)3/h8-10,13H,4-7,11-12H2,1-3H3
InChI Key:
FKTHVLUWUKYTPM-UHFFFAOYSA-N
SMILES:
CCOC(=O)CCCCCC(=O)c1cccc(c1)N(C)C
Properties
Complexity:
328
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
291.183g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
291.391g/mol
Monoisotopic Mass:
291.183g/mol
Rotatable Bond Count:
10
Topological Polar Surface Area:
46.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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