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826-71-1 | 4-Pyridinecarboxaldehyde, 3-hydroxy-2,5-dimethyl-, oxime
CAS No: 826-71-1 Catalog No: AG004WW8 MDL No:
Product Description
Catalog Number:
AG004WW8
Chemical Name:
4-Pyridinecarboxaldehyde, 3-hydroxy-2,5-dimethyl-, oxime
CAS Number:
826-71-1
Molecular Formula:
C8H10N2O2
Molecular Weight:
166.1772
IUPAC Name:
4-(hydroxyiminomethyl)-2,5-dimethylpyridin-3-ol
InChI:
InChI=1S/C8H10N2O2/c1-5-3-9-6(2)8(11)7(5)4-10-12/h3-4,11-12H,1-2H3
InChI Key:
YDDFJYFFDBUGEM-UHFFFAOYSA-N
SMILES:
ON=Cc1c(C)cnc(c1O)C
Properties
Complexity:
172
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
166.074g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
166.18g/mol
Monoisotopic Mass:
166.074g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
65.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
1
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