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88094-00-2 | 3(2H)-Pyridazinone, 4-chloro-2-ethyl-5-[(4-methoxyphenyl)methoxy]-
CAS No: 88094-00-2 Catalog No: AG004J5F MDL No:
Product Description
Catalog Number:
AG004J5F
Chemical Name:
3(2H)-Pyridazinone, 4-chloro-2-ethyl-5-[(4-methoxyphenyl)methoxy]-
CAS Number:
88094-00-2
Molecular Formula:
C14H15ClN2O3
Molecular Weight:
294.7335
IUPAC Name:
4-chloro-2-ethyl-5-[(4-methoxyphenyl)methoxy]pyridazin-3-one
InChI:
InChI=1S/C14H15ClN2O3/c1-3-17-14(18)13(15)12(8-16-17)20-9-10-4-6-11(19-2)7-5-10/h4-8H,3,9H2,1-2H3
InChI Key:
AFNGLQJKMLUKPD-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)COc1cnn(c(=O)c1Cl)CC
Properties
Complexity:
415
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
294.077g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
294.735g/mol
Monoisotopic Mass:
294.077g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
51.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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