Methyl 3-hydroxythiophene-2-carboxylate


Chemical Name: Methyl 3-hydroxythiophene-2-carboxylate
CAS Number: 5118-06-9
Product Number: AG003RSJ(AGN-PC-0WADVJ)
Synonyms:
MDL No:
Molecular Formula: C6H6O3S
Molecular Weight: 158.1750

Identification/Properties


Properties
MP:
38-43 °C(lit.)
BP:
232.304°C at 760 mmHg
Storage:
Keep in dry area;Room Temperature;
Form:
Solid
Computed Properties
Molecular Weight:
158.171g/mol
XLogP3:
2
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
2
Exact Mass:
158.004g/mol
Monoisotopic Mass:
158.004g/mol
Topological Polar Surface Area:
74.8A^2
Heavy Atom Count:
10
Formal Charge:
0
Complexity:
137
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:
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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