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189268-42-6 | 8-Quinolinol, 2-methyl-4-(1H-pyrazol-1-yl)-
CAS No: 189268-42-6 Catalog No: AG002I5M MDL No:
Product Description
Catalog Number:
AG002I5M
Chemical Name:
8-Quinolinol, 2-methyl-4-(1H-pyrazol-1-yl)-
CAS Number:
189268-42-6
Molecular Formula:
C13H11N3O
Molecular Weight:
225.2459
IUPAC Name:
2-methyl-4-pyrazol-1-ylquinolin-8-ol
InChI:
InChI=1S/C13H11N3O/c1-9-8-11(16-7-3-6-14-16)10-4-2-5-12(17)13(10)15-9/h2-8,17H,1H3
InChI Key:
CGFXFJLDDGWLRC-UHFFFAOYSA-N
SMILES:
Cc1nc2c(O)cccc2c(c1)n1cccn1
Properties
Complexity:
273
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
225.09g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
225.251g/mol
Monoisotopic Mass:
225.09g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
50.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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