3H-2-Benzopyran-3-one, 1,4-dihydro-


Chemical Name: 3H-2-Benzopyran-3-one, 1,4-dihydro-
CAS Number: 4385-35-7
Product Number: AG00I8CW(AGN-PC-0JLR4V)
Synonyms:
MDL No:
Molecular Formula: C9H8O2
Molecular Weight: 148.1586

Identification/Properties


Computed Properties
Molecular Weight:
148.161g/mol
XLogP3:
1.3
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
0
Exact Mass:
148.052g/mol
Monoisotopic Mass:
148.052g/mol
Topological Polar Surface Area:
26.3A^2
Heavy Atom Count:
11
Formal Charge:
0
Complexity:
165
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:
H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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