3-Furancarboxylic acid, 2,5-dimethyl-


Chemical Name: 3-Furancarboxylic acid, 2,5-dimethyl-
CAS Number: 636-44-2
Product Number: AG00EA3B(AGN-PC-0JL91I)
Synonyms:
MDL No:
Molecular Formula: C7H8O3
Molecular Weight: 140.1366

Identification/Properties


Properties
MP:
137-140 °C(lit.)
BP:
240.6 °C at 760 mmHg
Storage:
2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
140.138g/mol
XLogP3:
1.3
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
1
Exact Mass:
140.047g/mol
Monoisotopic Mass:
140.047g/mol
Topological Polar Surface Area:
50.4A^2
Heavy Atom Count:
10
Formal Charge:
0
Complexity:
144
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:
H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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