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Home > Aldehydes > 1289148-87-3
1289148-87-3 | 3-Pyridinecarboxaldehyde, 6-(1,1-dimethylethoxy)-4-methyl-
CAS No: 1289148-87-3 Catalog No: AG000YI8 MDL No:
Product Description
Catalog Number:
AG000YI8
Chemical Name:
3-Pyridinecarboxaldehyde, 6-(1,1-dimethylethoxy)-4-methyl-
CAS Number:
1289148-87-3
Molecular Formula:
C11H15NO2
Molecular Weight:
193.2423
IUPAC Name:
4-methyl-6-[(2-methylpropan-2-yl)oxy]pyridine-3-carbaldehyde
InChI:
InChI=1S/C11H15NO2/c1-8-5-10(14-11(2,3)4)12-6-9(8)7-13/h5-7H,1-4H3
InChI Key:
XQCKYEVVMKJYQY-UHFFFAOYSA-N
SMILES:
O=Cc1cnc(cc1C)OC(C)(C)C
Properties
Complexity:
198
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
193.11g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
193.246g/mol
Monoisotopic Mass:
193.11g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
39.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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