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88093-88-3 | 3(2H)-Pyridazinone, 4-chloro-5-[(4-methoxyphenyl)methoxy]-2-methyl-
CAS No: 88093-88-3 Catalog No: AG004GVX MDL No:
Product Description
Catalog Number:
AG004GVX
Chemical Name:
3(2H)-Pyridazinone, 4-chloro-5-[(4-methoxyphenyl)methoxy]-2-methyl-
CAS Number:
88093-88-3
Molecular Formula:
C13H13ClN2O3
Molecular Weight:
280.7069
IUPAC Name:
4-chloro-5-[(4-methoxyphenyl)methoxy]-2-methylpyridazin-3-one
InChI:
InChI=1S/C13H13ClN2O3/c1-16-13(17)12(14)11(7-15-16)19-8-9-3-5-10(18-2)6-4-9/h3-7H,8H2,1-2H3
InChI Key:
RICKYXIROBXAMP-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)COc1cnn(c(=O)c1Cl)C
Properties
Complexity:
401
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
280.061g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
280.708g/mol
Monoisotopic Mass:
280.061g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
51.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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