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102259-74-5 | Quinoline, 1,2,3,4-tetrahydro-6-methoxy-1-[2-(1-piperidinyl)ethyl]-, hydrochloride (1:2)
CAS No: 102259-74-5 Catalog No: AG00072B MDL No:
Product Description
Catalog Number:
AG00072B
Chemical Name:
Quinoline, 1,2,3,4-tetrahydro-6-methoxy-1-[2-(1-piperidinyl)ethyl]-, hydrochloride (1:2)
CAS Number:
102259-74-5
Molecular Formula:
C17H28Cl2N2O
Molecular Weight:
347.3230
IUPAC Name:
6-methoxy-1-(2-piperidin-1-ylethyl)-3,4-dihydro-2H-quinoline;dihydrochloride
InChI:
InChI=1S/C17H26N2O.2ClH/c1-20-16-7-8-17-15(14-16)6-5-11-19(17)13-12-18-9-3-2-4-10-18;;/h7-8,14H,2-6,9-13H2,1H3;2*1H
InChI Key:
BIJGNJBDBDXMDT-UHFFFAOYSA-N
SMILES:
COc1ccc2c(c1)CCCN2CCN1CCCCC1.Cl.Cl
Properties
Complexity:
291
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
346.158g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
347.324g/mol
Monoisotopic Mass:
346.158g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
15.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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