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667398-46-1 | 3-Pyridinemethanol, 5-hydroxy-4-(1H-imidazol-2-yl)-6-methyl-
CAS No: 667398-46-1 Catalog No: AG00H6SO MDL No:
Product Description
Catalog Number:
AG00H6SO
Chemical Name:
3-Pyridinemethanol, 5-hydroxy-4-(1H-imidazol-2-yl)-6-methyl-
CAS Number:
667398-46-1
Molecular Formula:
C10H11N3O2
Molecular Weight:
205.2132
IUPAC Name:
5-(hydroxymethyl)-4-(1H-imidazol-2-yl)-2-methylpyridin-3-ol
InChI:
InChI=1S/C10H11N3O2/c1-6-9(15)8(7(5-14)4-13-6)10-11-2-3-12-10/h2-4,14-15H,5H2,1H3,(H,11,12)
InChI Key:
QDSUBQFUHXJNOT-UHFFFAOYSA-N
SMILES:
OCc1cnc(c(c1c1ncc[nH]1)O)C
UNII:
0S2X76B92Q
Properties
Complexity:
215
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
205.085g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
205.217g/mol
Monoisotopic Mass:
205.085g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
82A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.2
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