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1000504-57-3 | 3-Pyridineethanamine, 6-ethoxy-
CAS No: 1000504-57-3 Catalog No: AG0000O5 MDL No:
Product Description
Catalog Number:
AG0000O5
Chemical Name:
3-Pyridineethanamine, 6-ethoxy-
CAS Number:
1000504-57-3
Molecular Formula:
C9H14N2O
Molecular Weight:
166.2203
IUPAC Name:
2-(6-ethoxypyridin-3-yl)ethanamine
InChI:
InChI=1S/C9H14N2O/c1-2-12-9-4-3-8(5-6-10)7-11-9/h3-4,7H,2,5-6,10H2,1H3
InChI Key:
RUWBWZPMYVSZJM-UHFFFAOYSA-N
SMILES:
NCCc1ccc(nc1)OCC
Properties
Complexity:
119
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
166.111g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
166.224g/mol
Monoisotopic Mass:
166.111g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
48.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
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