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69099-74-7 | 2H,3H,4H,4aH,5H-indeno[1,2-c]pyridazin-3-one
CAS No: 69099-74-7 Catalog No: AG01C3VN MDL No:MFCD00034330
Product Description
Catalog Number:
AG01C3VN
Chemical Name:
2H,3H,4H,4aH,5H-indeno[1,2-c]pyridazin-3-one
CAS Number:
69099-74-7
Molecular Formula:
C11H10N2O
Molecular Weight:
186.2099
MDL Number:
MFCD00034330
IUPAC Name:
2,4,4a,5-tetrahydroindeno[1,2-c]pyridazin-3-one
InChI:
InChI=1S/C11H10N2O/c14-10-6-8-5-7-3-1-2-4-9(7)11(8)13-12-10/h1-4,8H,5-6H2,(H,12,14)
InChI Key:
JUWKFPCTXSBEAD-UHFFFAOYSA-N
SMILES:
O=C1NN=C2C(C1)Cc1c2cccc1
Properties
Complexity:
298
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
186.079g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
186.214g/mol
Monoisotopic Mass:
186.079g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
41.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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