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158331-18-1 | 5H-Cyclopenta[b]pyridine, 3-bromo-6,7-dihydro-
CAS No: 158331-18-1 Catalog No: AG001Q4R MDL No:MFCD08706061
Product Description
Catalog Number:
AG001Q4R
Chemical Name:
5H-Cyclopenta[b]pyridine, 3-bromo-6,7-dihydro-
CAS Number:
158331-18-1
Molecular Formula:
C8H8BrN
Molecular Weight:
198.0598
MDL Number:
MFCD08706061
IUPAC Name:
3-bromo-6,7-dihydro-5H-cyclopenta[b]pyridine
InChI:
InChI=1S/C8H8BrN/c9-7-4-6-2-1-3-8(6)10-5-7/h4-5H,1-3H2
InChI Key:
AOUSQPREWBGRAO-UHFFFAOYSA-N
SMILES:
Brc1cnc2c(c1)CCC2
Properties
Complexity:
126
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
196.984g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
198.063g/mol
Monoisotopic Mass:
196.984g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
12.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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