1(2H)-Phthalazinone, 4-phenyl-


Chemical Name: 1(2H)-Phthalazinone, 4-phenyl-
CAS Number: 5004-45-5
Product Number: AG003LZ0(AGN-PC-0JN9DJ)
Synonyms:
MDL No:
Molecular Formula: C14H10N2O
Molecular Weight: 222.2420

Identification/Properties


Properties
MP:
240-244℃(lit.)
Form:
Solid
Computed Properties
Molecular Weight:
222.247g/mol
XLogP3:
2.7
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
1
Exact Mass:
222.079g/mol
Monoisotopic Mass:
222.079g/mol
Topological Polar Surface Area:
41.5A^2
Heavy Atom Count:
17
Formal Charge:
0
Complexity:
331
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
-
Hazard Statements:
H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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Chemical Structure



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