2H-1-Benzopyran-2-one, 4-hydroxy-3-(1-phenylpropyl)-


Chemical Name: 2H-1-Benzopyran-2-one, 4-hydroxy-3-(1-phenylpropyl)-
CAS Number: 435-97-2
Product Number: AG00DELD(AGN-PC-0AAI3X)
Synonyms:
MDL No:
Molecular Formula: C18H16O3
Molecular Weight: 280.3178

Identification/Properties


Computed Properties
Molecular Weight:
280.323g/mol
XLogP3:
3.6
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
3
Exact Mass:
280.11g/mol
Monoisotopic Mass:
280.11g/mol
Topological Polar Surface Area:
46.5A^2
Heavy Atom Count:
21
Formal Charge:
0
Complexity:
420
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
1
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:
H315-H319-H335-H350-H361
Precautionary Statements:
P261-P264-P271-P280-P302+P352-P304+P340-P305+P351+P338-P312-P362-P403+P233-P405-P501
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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