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1196156-01-0 | 1,7-Naphthyridine, 3-bromo-5,6,7,8-tetrahydro-
CAS No: 1196156-01-0 Catalog No: AG000PCY MDL No:
Product Description
Catalog Number:
AG000PCY
Chemical Name:
1,7-Naphthyridine, 3-bromo-5,6,7,8-tetrahydro-
CAS Number:
1196156-01-0
Molecular Formula:
C8H9BrN2
Molecular Weight:
213.0745
IUPAC Name:
3-bromo-5,6,7,8-tetrahydro-1,7-naphthyridine
InChI:
InChI=1S/C8H9BrN2/c9-7-3-6-1-2-10-5-8(6)11-4-7/h3-4,10H,1-2,5H2
InChI Key:
YKDQJOHDORCJFU-UHFFFAOYSA-N
SMILES:
Brc1cnc2c(c1)CCNC2
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:
1
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