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1788-55-2 | 3(2H)-PYRIDAZINONE, 6-PHENOXY-
CAS No: 1788-55-2 Catalog No: AG01EIEJ MDL No:MFCD27946301
Product Description
Catalog Number:
AG01EIEJ
Chemical Name:
3(2H)-PYRIDAZINONE, 6-PHENOXY-
CAS Number:
1788-55-2
Molecular Formula:
C10H8N2O2
Molecular Weight:
188.1827
MDL Number:
MFCD27946301
IUPAC Name:
3-phenoxy-1H-pyridazin-6-one
InChI:
InChI=1S/C10H8N2O2/c13-9-6-7-10(12-11-9)14-8-4-2-1-3-5-8/h1-7H,(H,11,13)
InChI Key:
KHTZJZTUOROSFN-UHFFFAOYSA-N
SMILES:
O=c1ccc(n[nH]1)Oc1ccccc1
Properties
Complexity:
278
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
188.059g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
188.186g/mol
Monoisotopic Mass:
188.059g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
50.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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