8-Bromo-1,2,3,4-tetrahydro-2,6-naphthyridine Dihydrochloride - CAS 2055840-70-3
Catalog: |
BB055095 |
Product Name: |
8-Bromo-1,2,3,4-tetrahydro-2,6-naphthyridine Dihydrochloride |
CAS: |
2055840-70-3 |
Synonyms: |
8-Bromo-1,2,3,4-tetrahydro-2,6-naphthyridine dihydrochloride; 8-Bromo-1,2,3,4-tetrahydro-2,6-naphthyridine 2HCl; 8-bromo-1,2,3,4-tetrahydro-2,6-naphthyridine; dihydrochloride |
IUPAC Name: | 8-bromo-1,2,3,4-tetrahydro-2,6-naphthyridinedihydrochloride |
Molecular Weight: | 213.08 + 2(36.46) |
Molecular Formula: | C8H9BrN2·2HCl |
Canonical SMILES: | C1CNCC2=C(C=NC=C21)Br.Cl.Cl |
InChI: | InChI=1S/C8H9BrN2.2ClH/c9-8-5-11-3-6-1-2-10-4-7(6)8/h3,5,10H,1-2,4H22*1H |
InChI Key: | SMPLYJFPRQXJMJ-UHFFFAOYSA-N |
Complexity: | 140 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 3 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 283.94827 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 3 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 283.94827 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 24.9Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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