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1159010-96-4 | 1,6-Naphthyridine, 3-bromo-5,6,7,8-tetrahydro-, hydrochloride (1:1)
CAS No: 1159010-96-4 Catalog No: AG000H2M MDL No:MFCD09701301
Product Description
Catalog Number:
AG000H2M
Chemical Name:
1,6-Naphthyridine, 3-bromo-5,6,7,8-tetrahydro-, hydrochloride (1:1)
CAS Number:
1159010-96-4
Molecular Formula:
C8H10BrClN2
Molecular Weight:
249.5354
MDL Number:
MFCD09701301
IUPAC Name:
3-bromo-5,6,7,8-tetrahydro-1,6-naphthyridine;hydrochloride
InChI:
InChI=1S/C8H9BrN2.ClH/c9-7-3-6-4-10-2-1-8(6)11-5-7;/h3,5,10H,1-2,4H2;1H
InChI Key:
UYPMMDKARAQFRH-UHFFFAOYSA-N
SMILES:
Brc1cc2CNCCc2nc1.Cl
Properties
Complexity:
140
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
247.972g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
249.536g/mol
Monoisotopic Mass:
247.972g/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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