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Home > Pyridines > 117135-43-0
117135-43-0 | 4(1H)-Pyridinone, 1,1'-(1,6-hexanediyl)bis[3-hydroxy-2-methyl-
CAS No: 117135-43-0 Catalog No: AG000DRT MDL No:
Product Description
Catalog Number:
AG000DRT
Chemical Name:
4(1H)-Pyridinone, 1,1'-(1,6-hexanediyl)bis[3-hydroxy-2-methyl-
CAS Number:
117135-43-0
Molecular Formula:
C18H24N2O4
Molecular Weight:
332.3942
IUPAC Name:
3-hydroxy-1-[6-(3-hydroxy-2-methyl-4-oxopyridin-1-yl)hexyl]-2-methylpyridin-4-one
InChI:
InChI=1S/C18H24N2O4/c1-13-17(23)15(21)7-11-19(13)9-5-3-4-6-10-20-12-8-16(22)18(24)14(20)2/h7-8,11-12,23-24H,3-6,9-10H2,1-2H3
InChI Key:
QINFICICDYQKSR-UHFFFAOYSA-N
SMILES:
Cc1n(CCCCCCn2ccc(=O)c(c2C)O)ccc(=O)c1O
Properties
Complexity:
587
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
332.174g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
332.4g/mol
Monoisotopic Mass:
332.174g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
81.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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