Thiophene, 3-hexyl-


Chemical Name: Thiophene, 3-hexyl-
CAS Number: 1693-86-3
Product Number: AG003JIR(AGN-PC-0JT08L)
Synonyms:
MDL No:
Molecular Formula: C10H16S
Molecular Weight: 168.2990

Identification/Properties


Properties
MP:
-39.15°C (estimate)
BP:
225.6°C at 760 mmHg
Storage:
Inert atmosphere;Room Temperature;
Form:
Liquid
Refractive Index:
n20/D 1.496(lit.)
Computed Properties
Molecular Weight:
168.298g/mol
XLogP3:
5
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
1
Rotatable Bond Count:
5
Exact Mass:
168.097g/mol
Monoisotopic Mass:
168.097g/mol
Topological Polar Surface Area:
28.2A^2
Heavy Atom Count:
11
Formal Charge:
0
Complexity:
90.9
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:
Danger
UN#:
1993
Hazard Statements:
H226-H302+H312+H332-H315-H319-H335
Precautionary Statements:
P261-P280-P305+P351+P338
Class:
3
Packing Group:

NMR Spectrum


Other Analytical Data


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