Thiophene, 3-butyl-


Chemical Name: Thiophene, 3-butyl-
CAS Number: 34722-01-5
Product Number: AG003J5P(AGN-PC-0JSZX6)
Synonyms:
MDL No: MFCD00143179
Molecular Formula: C8H12S
Molecular Weight: 140.2459

Identification/Properties


Properties
MP:
-56.9°C (estimate)
BP:
184°C at 760 mmHg
Storage:
Inert atmosphere;Room Temperature;
Form:
Liquid
Refractive Index:
n20/D 1.501(lit.)
Computed Properties
Molecular Weight:
140.244g/mol
XLogP3:
3.9
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
1
Rotatable Bond Count:
3
Exact Mass:
140.066g/mol
Monoisotopic Mass:
140.066g/mol
Topological Polar Surface Area:
28.2A^2
Heavy Atom Count:
9
Formal Charge:
0
Complexity:
71
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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