Home Halogens 5-(3-aminopyrrolidin-1-yl)-4-chloro-2,3-dihydropyridazin-3-one hydrochloride

5-(3-aminopyrrolidin-1-yl)-4-chloro-2,3-dihydropyridazin-3-one hydrochloride

CAS No.:
2137559-41-0
Catalog Number:
AG01EL6Q
Molecular Formula:
C8H12Cl2N4O
Molecular Weight:
251.1131
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Product Description
Catalog Number:
AG01EL6Q
Chemical Name:
5-(3-aminopyrrolidin-1-yl)-4-chloro-2,3-dihydropyridazin-3-one hydrochloride
CAS Number:
2137559-41-0
Molecular Formula:
C8H12Cl2N4O
Molecular Weight:
251.1131
MDL Number:
MFCD31457042
IUPAC Name:
5-(3-aminopyrrolidin-1-yl)-4-chloro-4H-pyridazin-3-one;hydrochloride
InChI:
InChI=1S/C8H11ClN4O.ClH/c9-7-6(3-11-12-8(7)14)13-2-1-5(10)4-13;/h3,5,7H,1-2,4,10H2;1H
InChI Key:
JXSADOKJCOKLNG-UHFFFAOYSA-N
SMILES:
NC1CCN(C1)c1cn[nH]c(=O)c1Cl.Cl
Properties
Complexity:
315  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
250.039g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
251.111g/mol
Monoisotopic Mass:
250.039g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
71A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
Properties