Home Nitriles 2-(piperazin-1-yl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile dihydrochloride

2-(piperazin-1-yl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile dihydrochloride

CAS No.:
2138062-24-3
Catalog Number:
AG01EJUK
Molecular Formula:
C14H20Cl2N4
Molecular Weight:
315.2414
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Product Description
Catalog Number:
AG01EJUK
Chemical Name:
2-(piperazin-1-yl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile dihydrochloride
CAS Number:
2138062-24-3
Molecular Formula:
C14H20Cl2N4
Molecular Weight:
315.2414
MDL Number:
MFCD31558922
IUPAC Name:
2-piperazin-1-yl-5,6,7,8-tetrahydroquinoline-3-carbonitrile;dihydrochloride
InChI:
InChI=1S/C14H18N4.2ClH/c15-10-12-9-11-3-1-2-4-13(11)17-14(12)18-7-5-16-6-8-18;;/h9,16H,1-8H2;2*1H
InChI Key:
DDGCJMZALFPUEC-UHFFFAOYSA-N
SMILES:
N#Cc1cc2CCCCc2nc1N1CCNCC1.Cl.Cl
Properties
Complexity:
328  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
314.107g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
315.242g/mol
Monoisotopic Mass:
314.107g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
52A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties