Acetic acid, [(ethoxythioxomethyl)thio]-, ethyl ester


Chemical Name: Acetic acid, [(ethoxythioxomethyl)thio]-, ethyl ester
CAS Number: 3278-34-0
Product Number: AG00I691(AGN-PC-009AIG)
Synonyms:
MDL No:
Molecular Formula: C7H12O3S2
Molecular Weight: 208.2984

Identification/Properties


Properties
BP:
104-105 °C(Press: 0.1 Torr)
Storage:
Inert atmosphere;2-8℃;
Form:
Liquid
Computed Properties
Molecular Weight:
208.29g/mol
XLogP3:
2.3
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
7
Exact Mass:
208.023g/mol
Monoisotopic Mass:
208.023g/mol
Topological Polar Surface Area:
92.9A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
159
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
Precautionary Statements:
P264-P270-P301+P312-P330
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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