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89816-14-8 | 2-Pyridinecarboxamide, 5-butoxy-
CAS No: 89816-14-8 Catalog No: AG003Y0Q MDL No:
Product Description
Catalog Number:
AG003Y0Q
Chemical Name:
2-Pyridinecarboxamide, 5-butoxy-
CAS Number:
89816-14-8
Molecular Formula:
C10H14N2O2
Molecular Weight:
194.2304
IUPAC Name:
5-butoxypyridine-2-carboxamide
InChI:
InChI=1S/C10H14N2O2/c1-2-3-6-14-8-4-5-9(10(11)13)12-7-8/h4-5,7H,2-3,6H2,1H3,(H2,11,13)
InChI Key:
BWPWOGKCDGXXRS-UHFFFAOYSA-N
SMILES:
CCCCOc1ccc(nc1)C(=O)N
Properties
Complexity:
185
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
194.106g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
194.234g/mol
Monoisotopic Mass:
194.106g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
65.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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