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115019-53-9 | 5H-Cyclopenta[b]pyridine-3-methanamine, 6,7-dihydro-, hydrochloride (1:2)
CAS No: 115019-53-9 Catalog No: AG000FOU MDL No:MFCD18459157
Product Description
Catalog Number:
AG000FOU
Chemical Name:
5H-Cyclopenta[b]pyridine-3-methanamine, 6,7-dihydro-, hydrochloride (1:2)
CAS Number:
115019-53-9
Molecular Formula:
C9H14Cl2N2
Molecular Weight:
221.1269
MDL Number:
MFCD18459157
IUPAC Name:
6,7-dihydro-5H-cyclopenta[b]pyridin-3-ylmethanamine;dihydrochloride
InChI:
InChI=1S/C9H12N2.2ClH/c10-5-7-4-8-2-1-3-9(8)11-6-7;;/h4,6H,1-3,5,10H2;2*1H
InChI Key:
OGNAKMPGKGSSPT-UHFFFAOYSA-N
SMILES:
NCc1cnc2c(c1)CCC2.Cl.Cl
Properties
Complexity:
136
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
220.053g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
221.125g/mol
Monoisotopic Mass:
220.053g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
38.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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