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1427381-10-9 | 5-(piperazin-1-yl)pyridine-2-carbonitrile dihydrochloride
CAS No: 1427381-10-9 Catalog No: AG01A3Q5 MDL No:MFCD23144064
Product Description
Catalog Number:
AG01A3Q5
Chemical Name:
5-(piperazin-1-yl)pyridine-2-carbonitrile dihydrochloride
CAS Number:
1427381-10-9
Molecular Formula:
C10H14Cl2N4
Molecular Weight:
261.1510
MDL Number:
MFCD23144064
IUPAC Name:
5-piperazin-1-ylpyridine-2-carbonitrile;dihydrochloride
InChI:
InChI=1S/C10H12N4.2ClH/c11-7-9-1-2-10(8-13-9)14-5-3-12-4-6-14;;/h1-2,8,12H,3-6H2;2*1H
InChI Key:
NDBAWWUHIXJMHQ-UHFFFAOYSA-N
SMILES:
N#Cc1ccc(cn1)N1CCNCC1.Cl.Cl
Properties
Complexity:
226
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
260.06g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
261.15g/mol
Monoisotopic Mass:
260.06g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
52A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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