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149365-48-0 | Phthalazine, 1-(4-pyridinylmethoxy)-
CAS No: 149365-48-0 Catalog No: AG001LLW MDL No:
Product Description
Catalog Number:
AG001LLW
Chemical Name:
Phthalazine, 1-(4-pyridinylmethoxy)-
CAS Number:
149365-48-0
Molecular Formula:
C14H11N3O
Molecular Weight:
237.2566
IUPAC Name:
1-(pyridin-4-ylmethoxy)phthalazine
InChI:
InChI=1S/C14H11N3O/c1-2-4-13-12(3-1)9-16-17-14(13)18-10-11-5-7-15-8-6-11/h1-9H,10H2
InChI Key:
MBIVNMNYHJXEJI-UHFFFAOYSA-N
SMILES:
n1ccc(cc1)COc1nncc2c1cccc2
Properties
Complexity:
255
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
237.09g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
237.262g/mol
Monoisotopic Mass:
237.09g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
47.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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