Benzo[b]thiophen-4(5H)-one, 6,7-dihydro-


Chemical Name: Benzo[b]thiophen-4(5H)-one, 6,7-dihydro-
CAS Number: 13414-95-4
Product Number: AG003N0W(AGN-PC-0JLUIQ)
Synonyms:
MDL No: MFCD00005861
Molecular Formula: C8H8OS
Molecular Weight: 152.2135

Identification/Properties


Properties
MP:
38-40 °C
BP:
267°C at 760 mmHg
Storage:
Keep in dry area;Room Temperature;
Form:
Liquid
Refractive Index:
1.5895-1.5915
Solubility:
Soluble in chloroform.
Computed Properties
Molecular Weight:
152.211g/mol
XLogP3:
1.7
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
0
Exact Mass:
152.03g/mol
Monoisotopic Mass:
152.03g/mol
Topological Polar Surface Area:
45.3A^2
Heavy Atom Count:
10
Formal Charge:
0
Complexity:
155
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
Precautionary Statements:
P280-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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