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1245643-55-3 | 4-(3-Fluorophenyl)oxan-4-amine hydrochloride
CAS No: 1245643-55-3 Catalog No: AG01FAL6 MDL No:
Product Description
Catalog Number:
AG01FAL6
Chemical Name:
4-(3-Fluorophenyl)oxan-4-amine hydrochloride
CAS Number:
1245643-55-3
Molecular Formula:
C11H15ClFNO
Molecular Weight:
231.6943
IUPAC Name:
4-(3-fluorophenyl)oxan-4-amine;hydrochloride
InChI:
InChI=1S/C11H14FNO.ClH/c12-10-3-1-2-9(8-10)11(13)4-6-14-7-5-11;/h1-3,8H,4-7,13H2;1H
InChI Key:
QBOUZNOITZMNHV-UHFFFAOYSA-N
SMILES:
Fc1cccc(c1)C1(N)CCOCC1.Cl
Properties
Complexity:
192
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
231.083g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
231.695g/mol
Monoisotopic Mass:
231.083g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
35.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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