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Home > Aldehydes > 1292369-52-8
1292369-52-8 | 3-Pyridinecarboxaldehyde, 6-(butylaMino)-
CAS No: 1292369-52-8 Catalog No: AG000YZY MDL No:
Product Description
Catalog Number:
AG000YZY
Chemical Name:
3-Pyridinecarboxaldehyde, 6-(butylaMino)-
CAS Number:
1292369-52-8
Molecular Formula:
C10H14N2O
Molecular Weight:
178.2310
IUPAC Name:
6-(butylamino)pyridine-3-carbaldehyde
InChI:
InChI=1S/C10H14N2O/c1-2-3-6-11-10-5-4-9(8-13)7-12-10/h4-5,7-8H,2-3,6H2,1H3,(H,11,12)
InChI Key:
FWNQVXVCCKYTFU-UHFFFAOYSA-N
SMILES:
CCCCNc1ccc(cn1)C=O
Properties
Complexity:
150
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
178.111g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
178.235g/mol
Monoisotopic Mass:
178.111g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
42A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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