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88347-52-8 | Pyridine, 2-(2-butoxy-1-methylethoxy)-6-phenyl-
CAS No: 88347-52-8 Catalog No: AG0045ZK MDL No:
Product Description
Catalog Number:
AG0045ZK
Chemical Name:
Pyridine, 2-(2-butoxy-1-methylethoxy)-6-phenyl-
CAS Number:
88347-52-8
Molecular Formula:
C18H23NO2
Molecular Weight:
285.3807
IUPAC Name:
2-(1-butoxypropan-2-yloxy)-6-phenylpyridine
InChI:
InChI=1S/C18H23NO2/c1-3-4-13-20-14-15(2)21-18-12-8-11-17(19-18)16-9-6-5-7-10-16/h5-12,15H,3-4,13-14H2,1-2H3
InChI Key:
DZRRLTVDBQRFOX-UHFFFAOYSA-N
SMILES:
CCCCOCC(Oc1cccc(n1)c1ccccc1)C
Properties
Complexity:
266
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
285.173g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
285.387g/mol
Monoisotopic Mass:
285.173g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
31.4A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
4.4
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