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Home > Bromides > 2055840-70-3
2055840-70-3 | 2,6-Naphthyridine, 8-bromo-1,2,3,4-tetrahydro-, hydrochloride (1:2)
CAS No: 2055840-70-3 Catalog No: AG002A78 MDL No:
Product Description
Catalog Number:
AG002A78
Chemical Name:
2,6-Naphthyridine, 8-bromo-1,2,3,4-tetrahydro-, hydrochloride (1:2)
CAS Number:
2055840-70-3
Molecular Formula:
C8H11BrCl2N2
Molecular Weight:
285.9963
IUPAC Name:
8-bromo-1,2,3,4-tetrahydro-2,6-naphthyridine;dihydrochloride
InChI:
InChI=1S/C8H9BrN2.2ClH/c9-8-5-11-3-6-1-2-10-4-7(6)8;;/h3,5,10H,1-2,4H2;2*1H
InChI Key:
SMPLYJFPRQXJMJ-UHFFFAOYSA-N
SMILES:
Brc1cncc2c1CNCC2.Cl.Cl
Properties
Complexity:
140
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
283.948g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
285.994g/mol
Monoisotopic Mass:
283.948g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
24.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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