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1172329-99-5 | 2-Quinolinamine, 3-ethyl-5,7-dimethyl-, hydrochloride (1:1)
CAS No: 1172329-99-5 Catalog No: AG000DYN MDL No:
Product Description
Catalog Number:
AG000DYN
Chemical Name:
2-Quinolinamine, 3-ethyl-5,7-dimethyl-, hydrochloride (1:1)
CAS Number:
1172329-99-5
Molecular Formula:
C13H17ClN2
Molecular Weight:
236.7405
IUPAC Name:
3-ethyl-5,7-dimethylquinolin-2-amine;hydrochloride
InChI:
InChI=1S/C13H16N2.ClH/c1-4-10-7-11-9(3)5-8(2)6-12(11)15-13(10)14;/h5-7H,4H2,1-3H3,(H2,14,15);1H
InChI Key:
WGSOQMICIJEAFB-UHFFFAOYSA-N
SMILES:
CCc1cc2c(C)cc(cc2nc1N)C.Cl
Properties
Complexity:
217
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
236.108g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
236.743g/mol
Monoisotopic Mass:
236.108g/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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