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Home > Indoles and Oxindole > 2060063-06-9
2060063-06-9 | 4-[(piperazin-1-yl)methyl]-1H-indole dihydrochloride
CAS No: 2060063-06-9 Catalog No: AG01BRGD MDL No:MFCD30535714
Product Description
Catalog Number:
AG01BRGD
Chemical Name:
4-[(piperazin-1-yl)methyl]-1H-indole dihydrochloride
CAS Number:
2060063-06-9
Molecular Formula:
C13H19Cl2N3
Molecular Weight:
288.2161
MDL Number:
MFCD30535714
IUPAC Name:
4-(piperazin-1-ylmethyl)-1H-indole;dihydrochloride
InChI:
InChI=1S/C13H17N3.2ClH/c1-2-11(10-16-8-6-14-7-9-16)12-4-5-15-13(12)3-1;;/h1-5,14-15H,6-10H2;2*1H
InChI Key:
HJLSOVNNHQQGHM-UHFFFAOYSA-N
SMILES:
N1CCN(CC1)Cc1cccc2c1cc[nH]2.Cl.Cl
Properties
Complexity:
225
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
287.096g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
288.216g/mol
Monoisotopic Mass:
287.096g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
31.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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