Ethanethioic acid, S-(2-methyl-3-furanyl) ester


Chemical Name: Ethanethioic acid, S-(2-methyl-3-furanyl) ester
CAS Number: 55764-25-5
Product Number: AG00DDZ6(AGN-PC-0JLGHR)
Synonyms:
MDL No:
Molecular Formula: C6H6O3S
Molecular Weight: 158.1750

Identification/Properties


Properties
BP:
225-235°C at 29.9 mmHg
Storage:
Keep in dry area;2-8℃;
Form:
Liquid
Computed Properties
Molecular Weight:
156.199g/mol
XLogP3:
1.7
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
2
Exact Mass:
156.025g/mol
Monoisotopic Mass:
156.025g/mol
Topological Polar Surface Area:
55.5A^2
Heavy Atom Count:
10
Formal Charge:
0
Complexity:
136
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#:
3272
Hazard Statements:
H226-H302-H315-H318-H335
Precautionary Statements:
P261-P280-P305+P351+P338
Class:
3
Packing Group:

NMR Spectrum


Other Analytical Data


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