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1393427-44-5 | [4-(Pyridin-2-ylmethyl)oxan-4-yl]methanamine
CAS No: 1393427-44-5 Catalog No: AG01FANU MDL No:
Product Description
Catalog Number:
AG01FANU
Chemical Name:
[4-(Pyridin-2-ylmethyl)oxan-4-yl]methanamine
CAS Number:
1393427-44-5
Molecular Formula:
C12H18N2O
Molecular Weight:
206.2841
IUPAC Name:
[4-(pyridin-2-ylmethyl)oxan-4-yl]methanamine
InChI:
InChI=1S/C12H18N2O/c13-10-12(4-7-15-8-5-12)9-11-3-1-2-6-14-11/h1-3,6H,4-5,7-10,13H2
InChI Key:
UTWPPGRZOANATB-UHFFFAOYSA-N
SMILES:
NCC1(CCOCC1)Cc1ccccn1
Properties
Complexity:
190
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:
3
Topological Polar Surface Area:
48.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
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