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1588441-25-1 | Spiro[isoquinoline-4(1H),4'-piperidine], 2,3-dihydro-, hydrochloride (1:2)
CAS No: 1588441-25-1 Catalog No: AG001QXI MDL No:MFCD26793567
Product Description
Catalog Number:
AG001QXI
Chemical Name:
Spiro[isoquinoline-4(1H),4'-piperidine], 2,3-dihydro-, hydrochloride (1:2)
CAS Number:
1588441-25-1
Molecular Formula:
C13H20Cl2N2
Molecular Weight:
275.2173
MDL Number:
MFCD26793567
IUPAC Name:
spiro[2,3-dihydro-1H-isoquinoline-4,4'-piperidine];dihydrochloride
InChI:
InChI=1S/C13H18N2.2ClH/c1-2-4-12-11(3-1)9-15-10-13(12)5-7-14-8-6-13;;/h1-4,14-15H,5-10H2;2*1H
InChI Key:
HTMHZEDALOUSBU-UHFFFAOYSA-N
SMILES:
N1CCC2(CC1)CNCc1c2cccc1.Cl.Cl
Properties
Complexity:
221
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
274.1g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
275.217g/mol
Monoisotopic Mass:
274.1g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
24.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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