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Home > Pyridines > 122001-78-9
122001-78-9 | 3H-Cyclopenta[c]pyridazin-3-one, 2,5,6,7-tetrahydro-
CAS No: 122001-78-9 Catalog No: AG0016KJ MDL No:MFCD07757617
Product Description
Catalog Number:
AG0016KJ
Chemical Name:
3H-Cyclopenta[c]pyridazin-3-one, 2,5,6,7-tetrahydro-
CAS Number:
122001-78-9
Molecular Formula:
C7H8N2O
Molecular Weight:
136.1512
MDL Number:
MFCD07757617
IUPAC Name:
2,5,6,7-tetrahydrocyclopenta[c]pyridazin-3-one
InChI:
InChI=1S/C7H8N2O/c10-7-4-5-2-1-3-6(5)8-9-7/h4H,1-3H2,(H,9,10)
InChI Key:
HZLVYABRXDPPSA-UHFFFAOYSA-N
SMILES:
O=c1[nH]nc2c(c1)CCC2
Properties
Complexity:
240
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
136.064g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
136.154g/mol
Monoisotopic Mass:
136.064g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
41.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.1
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