Home Bromides 1023813-80-0
1023813-80-0,MFCD09881254
Catalog No.:AA00078E
1023813-80-0 | 6-Bromo-1,2,3,4-tetrahydro-1,8-naphthyridine
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Technical Information
Catalog Number:
AA00078E
Chemical Name:
6-Bromo-1,2,3,4-tetrahydro-1,8-naphthyridine
CAS Number:
1023813-80-0
Molecular Formula:
C8H9BrN2
Molecular Weight:
213.0745
MDL Number:
MFCD09881254
IUPAC Name:
6-bromo-1,2,3,4-tetrahydro-1,8-naphthyridine
InChI:
InChI=1S/C8H9BrN2/c9-7-4-6-2-1-3-10-8(6)11-5-7/h4-5H,1-3H2,(H,10,11)
InChI Key:
OVYOPQIKOHSBSV-UHFFFAOYSA-N
SMILES:
Brc1cc2CCCNc2nc1
Properties
Computed Properties
 
Complexity:
140  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
211.995g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
213.078g/mol
Monoisotopic Mass:
211.995g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
24.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  

Synonyms
 
6-bromo-1,2,3,4-tetrahydro-1,8-naphthyridine 
1023813-80-0 
AKOS000276570 
AB54509 
MCULE-2609789621 
AJ-82378 
AS-35779 
SC-14759 
6-Bromo-1,2,3,4-tetrahydro-[1,8]naphthyridine 
1,8-Naphthyridine, 6-bromo-1,2,3,4-tetrahydro- 
6-bromo-1,2,3,4-tetrahydropyridino[2,3-b]pyridine 
F1957-0202 
5,6,7,8-TETRAHYDRO-[1,8]NAPHTHYRIDINE-3-BROMIDE 
Z2832014032 
SCHEMBL1258438 
DTXSID80591623 
OVYOPQIKOHSBSV-UHFFFAOYSA-N 
MFCD09881254 
SBB081655 
STL227830 
ZINC26460214 
Literature
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