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87426-02-6 | 3(2H)-Pyridazinone, 6-[(2-chlorophenyl)methoxy]-
CAS No: 87426-02-6 Catalog No: AG004G6U MDL No:
Product Description
Catalog Number:
AG004G6U
Chemical Name:
3(2H)-Pyridazinone, 6-[(2-chlorophenyl)methoxy]-
CAS Number:
87426-02-6
Molecular Formula:
C11H9ClN2O2
Molecular Weight:
236.6544
IUPAC Name:
3-[(2-chlorophenyl)methoxy]-1H-pyridazin-6-one
InChI:
InChI=1S/C11H9ClN2O2/c12-9-4-2-1-3-8(9)7-16-11-6-5-10(15)13-14-11/h1-6H,7H2,(H,13,15)
InChI Key:
ZABBJIYAYDHKTI-UHFFFAOYSA-N
SMILES:
Clc1ccccc1COc1ccc(=O)[nH]n1
Properties
Complexity:
328
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
236.035g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
236.655g/mol
Monoisotopic Mass:
236.035g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
50.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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