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951886-01-4

951886-01-4 | Ethyl 8-[4-(N,N-Dimethylamino)phenyl]-8-oxooctanoate

CAS No: 951886-01-4 Catalog No: AG01F8NF MDL No:

Product Description

Catalog Number:
AG01F8NF
Chemical Name:
Ethyl 8-[4-(N,N-Dimethylamino)phenyl]-8-oxooctanoate
CAS Number:
951886-01-4
Molecular Formula:
C18H27NO3
Molecular Weight:
305.4119
IUPAC Name:
ethyl 8-[4-(dimethylamino)phenyl]-8-oxooctanoate
InChI:
InChI=1S/C18H27NO3/c1-4-22-18(21)10-8-6-5-7-9-17(20)15-11-13-16(14-12-15)19(2)3/h11-14H,4-10H2,1-3H3
InChI Key:
ROVQFTVFFKMQNF-UHFFFAOYSA-N
SMILES:
CCOC(=O)CCCCCCC(=O)c1ccc(cc1)N(C)C

Properties

Complexity:
333  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
305.199g/mol
Formal Charge:
0
Heavy Atom Count:
22  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
305.418g/mol
Monoisotopic Mass:
305.199g/mol
Rotatable Bond Count:
11  
Topological Polar Surface Area:
46.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7  

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