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90685-58-8 | 6,7-Dihydro-5H-cyclopenta[b]pyridine 1-oxide
CAS No: 90685-58-8 Catalog No: AG00GUAK MDL No:MFCD11110318
Product Description
Catalog Number:
AG00GUAK
Chemical Name:
6,7-Dihydro-5H-cyclopenta[b]pyridine 1-oxide
CAS Number:
90685-58-8
Molecular Formula:
C8H9NO
Molecular Weight:
135.1632
MDL Number:
MFCD11110318
IUPAC Name:
1-oxido-6,7-dihydro-5H-cyclopenta[b]pyridin-1-ium
InChI:
InChI=1S/C8H9NO/c10-9-6-2-4-7-3-1-5-8(7)9/h2,4,6H,1,3,5H2
InChI Key:
BSLCBYOXMDACSD-UHFFFAOYSA-N
SMILES:
[O-][n+]1cccc2c1CCC2
Properties
Complexity:
126
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
135.068g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
135.166g/mol
Monoisotopic Mass:
135.068g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
25.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5
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