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1172906-16-9

1172906-16-9 | 2-Quinolinamine, 6-ethoxy-3-ethyl-, hydrochloride (1:1)

CAS No: 1172906-16-9 Catalog No: AG000E24 MDL No:

Product Description

Catalog Number:
AG000E24
Chemical Name:
2-Quinolinamine, 6-ethoxy-3-ethyl-, hydrochloride (1:1)
CAS Number:
1172906-16-9
Molecular Formula:
C13H17ClN2O
Molecular Weight:
252.7399
IUPAC Name:
6-ethoxy-3-ethylquinolin-2-amine;hydrochloride
InChI:
InChI=1S/C13H16N2O.ClH/c1-3-9-7-10-8-11(16-4-2)5-6-12(10)15-13(9)14;/h5-8H,3-4H2,1-2H3,(H2,14,15);1H
InChI Key:
JRNCLUJIHHZJBR-UHFFFAOYSA-N
SMILES:
CCOc1ccc2c(c1)cc(c(n2)N)CC.Cl

Properties

Complexity:
222  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
252.103g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
252.742g/mol
Monoisotopic Mass:
252.103g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
48.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0

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