1,3,5-Trithiane


Chemical Name: 1,3,5-Trithiane
CAS Number: 291-21-4
Product Number: AG002XBC(AGN-PC-0JK8YK)
Synonyms:
MDL No:
Molecular Formula: C3H6S3
Molecular Weight: 138.2747

Identification/Properties


Properties
MP:
215-220 °C (dec.)(lit.)
BP:
376.28°C (estimate)
Form:
Solid
Refractive Index:
1.7000 (estimate)
Computed Properties
Molecular Weight:
138.261g/mol
XLogP3:
2.2
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
0
Exact Mass:
137.963g/mol
Monoisotopic Mass:
137.963g/mol
Topological Polar Surface Area:
75.9A^2
Heavy Atom Count:
6
Formal Charge:
0
Complexity:
21.5
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#:
-
Hazard Statements:
H316-H320
Precautionary Statements:
P264-P337+P313-P305+P351+P338-P332+P313
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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