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Home > Pyridines > 1598032-78-0
1598032-78-0 | 6-(pyrrolidin-3-yl)-2,3-dihydropyridazin-3-one
CAS No: 1598032-78-0 Catalog No: AG01E95Y MDL No:MFCD27980871
Product Description
Catalog Number:
AG01E95Y
Chemical Name:
6-(pyrrolidin-3-yl)-2,3-dihydropyridazin-3-one
CAS Number:
1598032-78-0
Molecular Formula:
C8H11N3O
Molecular Weight:
165.1924
MDL Number:
MFCD27980871
IUPAC Name:
3-pyrrolidin-3-yl-1H-pyridazin-6-one
InChI:
InChI=1S/C8H11N3O/c12-8-2-1-7(10-11-8)6-3-4-9-5-6/h1-2,6,9H,3-5H2,(H,11,12)
InChI Key:
SRKTYRRCSOKFNG-UHFFFAOYSA-N
SMILES:
O=c1ccc(n[nH]1)C1CNCC1
Properties
Complexity:
257
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
165.09g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
165.196g/mol
Monoisotopic Mass:
165.09g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
53.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.7
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