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Home > Pyridines > 1422067-86-4
1422067-86-4 | (4aS,7R,7aR)-7-((6-methylpyridin-2-yl)methoxy)octahydrocyclopenta[b][1,4]oxazine
CAS No: 1422067-86-4 Catalog No: AG01DHL1 MDL No:
Product Description
Catalog Number:
AG01DHL1
Chemical Name:
(4aS,7R,7aR)-7-((6-methylpyridin-2-yl)methoxy)octahydrocyclopenta[b][1,4]oxazine
CAS Number:
1422067-86-4
Molecular Formula:
C14H20N2O2
Molecular Weight:
248.3208
IUPAC Name:
(4aS,7R,7aR)-7-[(6-methylpyridin-2-yl)methoxy]-2,3,4,4a,5,6,7,7a-octahydrocyclopenta[b][1,4]oxazine
InChI:
InChI=1S/C14H20N2O2/c1-10-3-2-4-11(16-10)9-18-13-6-5-12-14(13)17-8-7-15-12/h2-4,12-15H,5-9H2,1H3/t12-,13+,14+/m0/s1
InChI Key:
ABWRIRXKQXZJLW-BFHYXJOUSA-N
SMILES:
Cc1cccc(n1)CO[C@@H]1CC[C@H]2[C@H]1OCCN2
Properties
Complexity:
275
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
3
Defined Bond Stereocenter Count:
0
Exact Mass:
248.152g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
248.326g/mol
Monoisotopic Mass:
248.152g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
43.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
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