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1170892-50-8 | 2-Quinolinamine, 5-chloro-3-ethyl-8-methyl-, hydrochloride (1:1)
CAS No: 1170892-50-8 Catalog No: AG000DP3 MDL No:
Product Description
Catalog Number:
AG000DP3
Chemical Name:
2-Quinolinamine, 5-chloro-3-ethyl-8-methyl-, hydrochloride (1:1)
CAS Number:
1170892-50-8
Molecular Formula:
C12H14Cl2N2
Molecular Weight:
257.1590
IUPAC Name:
5-chloro-3-ethyl-8-methylquinolin-2-amine;hydrochloride
InChI:
InChI=1S/C12H13ClN2.ClH/c1-3-8-6-9-10(13)5-4-7(2)11(9)15-12(8)14;/h4-6H,3H2,1-2H3,(H2,14,15);1H
InChI Key:
DIOQONFBNLCDCV-UHFFFAOYSA-N
SMILES:
CCc1cc2c(Cl)ccc(c2nc1N)C.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:
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:
1
Topological Polar Surface Area:
38.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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