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Home > Pyridines > 845861-39-4
845861-39-4 | 1H-Pyrrolo[3,2-b]pyridine, 5-propoxy-3-(1,2,3,6-tetrahydro-4-pyridinyl)-,monohydrochloride
CAS No: 845861-39-4 Catalog No: AG01CC7P MDL No:
Product Description
Catalog Number:
AG01CC7P
Chemical Name:
1H-Pyrrolo[3,2-b]pyridine, 5-propoxy-3-(1,2,3,6-tetrahydro-4-pyridinyl)-,monohydrochloride
CAS Number:
845861-39-4
Molecular Formula:
C15H20ClN3O
Molecular Weight:
293.7918
IUPAC Name:
5-propoxy-3-(1,2,3,6-tetrahydropyridin-4-yl)-1H-pyrrolo[3,2-b]pyridine;hydrochloride
InChI:
InChI=1S/C15H19N3O.ClH/c1-2-9-19-14-4-3-13-15(18-14)12(10-17-13)11-5-7-16-8-6-11;/h3-5,10,16-17H,2,6-9H2,1H3;1H
InChI Key:
PIIOXKQIZCVXMD-UHFFFAOYSA-N
SMILES:
CCCOc1ccc2c(n1)c(c[nH]2)C1=CCNCC1.Cl
Properties
Complexity:
331
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
293.129g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
293.795g/mol
Monoisotopic Mass:
293.129g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
49.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Literature
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