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1249522-16-4 | [6-(Oxan-4-ylmethoxy)pyridin-3-yl]methanamine
CAS No: 1249522-16-4 Catalog No: AG01FAA0 MDL No:
Product Description
Catalog Number:
AG01FAA0
Chemical Name:
[6-(Oxan-4-ylmethoxy)pyridin-3-yl]methanamine
CAS Number:
1249522-16-4
Molecular Formula:
C12H18N2O2
Molecular Weight:
222.2835
IUPAC Name:
[6-(oxan-4-ylmethoxy)pyridin-3-yl]methanamine
InChI:
InChI=1S/C12H18N2O2/c13-7-11-1-2-12(14-8-11)16-9-10-3-5-15-6-4-10/h1-2,8,10H,3-7,9,13H2
InChI Key:
VEDIUDCVNNBVLZ-UHFFFAOYSA-N
SMILES:
NCc1ccc(nc1)OCC1CCOCC1
Properties
Complexity:
196
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
222.137g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
222.288g/mol
Monoisotopic Mass:
222.137g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
57.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
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