2-Propene-1-sulfinothioic acid, S-2-propenyl ester


Chemical Name: 2-Propene-1-sulfinothioic acid, S-2-propenyl ester
CAS Number: 539-86-6
Product Number: AG00ILMW(AGN-PC-0946A0)
Synonyms:
MDL No:
Molecular Formula: C6H10OS2
Molecular Weight: 162.2730

Identification/Properties


Properties
MP:
25°C
BP:
248.6°C at 760 mmHg
Storage:
Keep in dry area;2-8℃;
Form:
Liquid
Refractive Index:
nD20 1.561
Computed Properties
Molecular Weight:
162.265g/mol
XLogP3:
1.3
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
5
Exact Mass:
162.017g/mol
Monoisotopic Mass:
162.017g/mol
Topological Polar Surface Area:
61.6A^2
Heavy Atom Count:
9
Formal Charge:
0
Complexity:
120
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
1
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:
H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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