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1170592-36-5

1170592-36-5 | 2-Quinolinamine, 7-bromo-3-ethyl-, hydrochloride (1:1)

CAS No: 1170592-36-5 Catalog No: AG000DN1 MDL No:

Product Description

Catalog Number:
AG000DN1
Chemical Name:
2-Quinolinamine, 7-bromo-3-ethyl-, hydrochloride (1:1)
CAS Number:
1170592-36-5
Molecular Formula:
C11H12BrClN2
Molecular Weight:
287.5834
IUPAC Name:
7-bromo-3-ethylquinolin-2-amine;hydrochloride
InChI:
InChI=1S/C11H11BrN2.ClH/c1-2-7-5-8-3-4-9(12)6-10(8)14-11(7)13;/h3-6H,2H2,1H3,(H2,13,14);1H
InChI Key:
CHSMSDFKMGYLRI-UHFFFAOYSA-N
SMILES:
CCc1cc2ccc(cc2nc1N)Br.Cl

Properties

Complexity:
198  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
285.987g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
287.585g/mol
Monoisotopic Mass:
285.987g/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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