ethyl 5-methyl-2-(trifluoromethyl)furan-3-carboxylate


Chemical Name: ethyl 5-methyl-2-(trifluoromethyl)furan-3-carboxylate
CAS Number: 17515-73-0
Product Number: AG0020DD(AGN-PC-0KK8D7)
Synonyms:
MDL No:
Molecular Formula: C9H9F3O3
Molecular Weight: 222.1612

Identification/Properties


Properties
BP:
244.3°C at 760 mmHg
Storage:
Keep in dry area;2-8℃;
Computed Properties
Molecular Weight:
222.163g/mol
XLogP3:
2.5
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
6
Rotatable Bond Count:
3
Exact Mass:
222.05g/mol
Monoisotopic Mass:
222.05g/mol
Topological Polar Surface Area:
39.4A^2
Heavy Atom Count:
15
Formal Charge:
0
Complexity:
239
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:
H302-H315-H319-H335
Precautionary Statements:
P261-P264-P270-P271-P280-P301+P312+P330-P302+P352-P304+P340+P312-P305+P351+P338-P332+P313-P337+P313-P362-P403+P233-P405-P501
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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