Thiophenethiol


Chemical Name: Thiophenethiol
CAS Number: 7774-74-5
Product Number: AG003HYB(AGN-PC-0WAFE9)
Synonyms:
MDL No:
Molecular Formula: C4H4S2
Molecular Weight: 116.2046

Identification/Properties


Properties
BP:
129°C at 760 mmHg
Storage:
Inert atmosphere;2-8℃;
Form:
Solid
Stability:
Air Sensitive
Refractive Index:
n20/D 1.62(lit.)
Computed Properties
Molecular Weight:
116.196g/mol
XLogP3:
2.2
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
0
Exact Mass:
115.975g/mol
Monoisotopic Mass:
115.975g/mol
Topological Polar Surface Area:
29.2A^2
Heavy Atom Count:
6
Formal Charge:
0
Complexity:
44.8
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-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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