2H-1-Benzopyran-2-one, 7-(diethylamino)-4-methyl-


Chemical Name: 2H-1-Benzopyran-2-one, 7-(diethylamino)-4-methyl-
CAS Number: 91-44-1
Product Number: AG00IGE2(AGN-PC-0JK7VU)
Synonyms:
MDL No:
Molecular Formula: C14H17NO2
Molecular Weight: 231.2903

Identification/Properties


Computed Properties
Molecular Weight:
231.295g/mol
XLogP3:
3.1
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
3
Exact Mass:
231.126g/mol
Monoisotopic Mass:
231.126g/mol
Topological Polar Surface Area:
29.5A^2
Heavy Atom Count:
17
Formal Charge:
0
Complexity:
320
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#:
N/A
Hazard Statements:
H302-H315-H319
Precautionary Statements:
P261-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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