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1171447-48-5 | 2-Quinolinamine, 6-chloro-3-propyl-, hydrochloride (1:1)
CAS No: 1171447-48-5 Catalog No: AG000DSE MDL No:
Product Description
Catalog Number:
AG000DSE
Chemical Name:
2-Quinolinamine, 6-chloro-3-propyl-, hydrochloride (1:1)
CAS Number:
1171447-48-5
Molecular Formula:
C12H14Cl2N2
Molecular Weight:
257.1590
IUPAC Name:
6-chloro-3-propylquinolin-2-amine;hydrochloride
InChI:
InChI=1S/C12H13ClN2.ClH/c1-2-3-8-6-9-7-10(13)4-5-11(9)15-12(8)14;/h4-7H,2-3H2,1H3,(H2,14,15);1H
InChI Key:
XQXIIOOKYPRAQE-UHFFFAOYSA-N
SMILES:
CCCc1cc2cc(Cl)ccc2nc1N.Cl
Properties
Complexity:
210
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
256.053g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
257.158g/mol
Monoisotopic Mass:
256.053g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
38.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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