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124410-14-6 | 5-Pyrimidinol, 2-[4-(decyloxy)phenyl]-
CAS No: 124410-14-6 Catalog No: AG000LZK MDL No:
Product Description
Catalog Number:
AG000LZK
Chemical Name:
5-Pyrimidinol, 2-[4-(decyloxy)phenyl]-
CAS Number:
124410-14-6
Molecular Formula:
C20H28N2O2
Molecular Weight:
328.4485
IUPAC Name:
2-(4-decoxyphenyl)pyrimidin-5-ol
InChI:
InChI=1S/C20H28N2O2/c1-2-3-4-5-6-7-8-9-14-24-19-12-10-17(11-13-19)20-21-15-18(23)16-22-20/h10-13,15-16,23H,2-9,14H2,1H3
InChI Key:
TVDIQDRTQAZGDG-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCOc1ccc(cc1)c1ncc(cn1)O
Properties
Complexity:
298
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
328.215g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
328.456g/mol
Monoisotopic Mass:
328.215g/mol
Rotatable Bond Count:
11
Topological Polar Surface Area:
55.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
6
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