2H-1-Benzopyran-2-one, 7-(dimethylamino)-4-(trifluoromethyl)-


Chemical Name: 2H-1-Benzopyran-2-one, 7-(dimethylamino)-4-(trifluoromethyl)-
CAS Number: 53518-14-2
Product Number: AG003P2L(AGN-PC-0JLEE5)
Synonyms:
MDL No:
Molecular Formula: C12H10F3NO2
Molecular Weight: 257.2085096

Identification/Properties


Properties
MP:
147-149 °C(lit.)
BP:
323.7°C at 760 mmHg
Storage:
Room Temperature;
Form:
Solid
Computed Properties
Molecular Weight:
257.212g/mol
XLogP3:
2.9
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
6
Rotatable Bond Count:
1
Exact Mass:
257.066g/mol
Monoisotopic Mass:
257.066g/mol
Topological Polar Surface Area:
29.5A^2
Heavy Atom Count:
18
Formal Charge:
0
Complexity:
376
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
Precautionary Statements:
P264-P280-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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