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1439899-46-3 | [4-(4-Methylpyridin-2-yl)oxan-4-yl]methanamine
CAS No: 1439899-46-3 Catalog No: AG01FA3O MDL No:
Product Description
Catalog Number:
AG01FA3O
Chemical Name:
[4-(4-Methylpyridin-2-yl)oxan-4-yl]methanamine
CAS Number:
1439899-46-3
Molecular Formula:
C12H18N2O
Molecular Weight:
206.2841
IUPAC Name:
[4-(4-methylpyridin-2-yl)oxan-4-yl]methanamine
InChI:
InChI=1S/C12H18N2O/c1-10-2-5-14-11(8-10)12(9-13)3-6-15-7-4-12/h2,5,8H,3-4,6-7,9,13H2,1H3
InChI Key:
QZHXHUWNXVXTFP-UHFFFAOYSA-N
SMILES:
NCC1(CCOCC1)c1nccc(c1)C
Properties
Complexity:
202
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
206.142g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
206.289g/mol
Monoisotopic Mass:
206.142g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
48.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
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