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Home > Pyridines > 898779-43-6
898779-43-6 | 2-DODECANOYLPYRIDINE
CAS No: 898779-43-6 Catalog No: AG00GXLU MDL No:
Product Description
Catalog Number:
AG00GXLU
Chemical Name:
2-DODECANOYLPYRIDINE
CAS Number:
898779-43-6
Molecular Formula:
C17H27NO
Molecular Weight:
261.4024
IUPAC Name:
1-pyridin-2-yldodecan-1-one
InChI:
InChI=1S/C17H27NO/c1-2-3-4-5-6-7-8-9-10-14-17(19)16-13-11-12-15-18-16/h11-13,15H,2-10,14H2,1H3
InChI Key:
NIEKSWJGRZTVOV-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCCC(=O)c1ccccn1
Properties
Complexity:
227
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
261.209g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
261.409g/mol
Monoisotopic Mass:
261.209g/mol
Rotatable Bond Count:
11
Topological Polar Surface Area:
30A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6
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