Benzo[b]thiophene-2-carboxaldehyde, 3-methyl-


Chemical Name: Benzo[b]thiophene-2-carboxaldehyde, 3-methyl-
CAS Number: 22053-74-3
Product Number: AG003JQM(AGN-PC-0JS95T)
Synonyms:
MDL No:
Molecular Formula: C10H8OS
Molecular Weight: 176.2349

Identification/Properties


Properties
MP:
88-90°C
BP:
318.9 °C at 760 mmHg
Storage:
Keep in dry area;2-8℃;
Form:
Solid
Stability:
Air Sensitive
Computed Properties
Molecular Weight:
176.233g/mol
XLogP3:
3.1
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
1
Exact Mass:
176.03g/mol
Monoisotopic Mass:
176.03g/mol
Topological Polar Surface Area:
45.3A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
181
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


NMR Spectrum


Other Analytical Data


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