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Home > Pyridines > 2059975-85-6
2059975-85-6 | 3-{1H-pyrrolo[2,3-b]pyridin-3-yl}piperidine dihydrochloride
CAS No: 2059975-85-6 Catalog No: AG01C08X MDL No:MFCD30497881
Product Description
Catalog Number:
AG01C08X
Chemical Name:
3-{1H-pyrrolo[2,3-b]pyridin-3-yl}piperidine dihydrochloride
CAS Number:
2059975-85-6
Molecular Formula:
C12H17Cl2N3
Molecular Weight:
274.1895
MDL Number:
MFCD30497881
IUPAC Name:
3-piperidin-3-yl-1H-pyrrolo[2,3-b]pyridine;dihydrochloride
InChI:
InChI=1S/C12H15N3.2ClH/c1-3-9(7-13-5-1)11-8-15-12-10(11)4-2-6-14-12;;/h2,4,6,8-9,13H,1,3,5,7H2,(H,14,15);2*1H
InChI Key:
TZQXOEJUJYNQST-UHFFFAOYSA-N
SMILES:
C1CCC(CN1)c1c[nH]c2c1cccn2.Cl.Cl
Properties
Complexity:
219
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
273.08g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
274.189g/mol
Monoisotopic Mass:
273.08g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
40.7A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
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