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1402232-94-3 | [4-(Pyridin-3-yl)oxan-4-yl]methanamine dihydrochloride
CAS No: 1402232-94-3 Catalog No: AG01F80S MDL No:
Product Description
Catalog Number:
AG01F80S
Chemical Name:
[4-(Pyridin-3-yl)oxan-4-yl]methanamine dihydrochloride
CAS Number:
1402232-94-3
Molecular Formula:
C11H18Cl2N2O
Molecular Weight:
265.1794
IUPAC Name:
(4-pyridin-3-yloxan-4-yl)methanamine;dihydrochloride
InChI:
InChI=1S/C11H16N2O.2ClH/c12-9-11(3-6-14-7-4-11)10-2-1-5-13-8-10;;/h1-2,5,8H,3-4,6-7,9,12H2;2*1H
InChI Key:
FLWQZNSZKPFVHN-UHFFFAOYSA-N
SMILES:
NCC1(CCOCC1)c1cccnc1.Cl.Cl
Properties
Complexity:
178
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
264.08g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
265.178g/mol
Monoisotopic Mass:
264.08g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
48.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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