3-Furancarboxylic acid, 5-methyl-2-(trifluoromethyl)-


Chemical Name: 3-Furancarboxylic acid, 5-methyl-2-(trifluoromethyl)-
CAS Number: 17515-74-1
Product Number: AG0020DC(AGN-PC-0KL1HX)
Synonyms:
MDL No:
Molecular Formula: C7H5F3O3
Molecular Weight: 194.1080

Identification/Properties


Computed Properties
Molecular Weight:
194.109g/mol
XLogP3:
1.8
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
6
Rotatable Bond Count:
1
Exact Mass:
194.019g/mol
Monoisotopic Mass:
194.019g/mol
Topological Polar Surface Area:
50.4A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
214
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#:
3261
Hazard Statements:
H314-H318
Precautionary Statements:
P280-P301+P330+P331-P305+P351+P338-P310
Class:
8
Packing Group:

NMR Spectrum


Other Analytical Data


Request for Quotation


Customer Feedback