5-Pyrimidinecarboxylic acid, 2,4-bis(trifluoromethyl)-, ethyl ester


Chemical Name: 5-Pyrimidinecarboxylic acid, 2,4-bis(trifluoromethyl)-, ethyl ester
CAS Number: 188781-15-9
Product Number: AG002HBE(AGN-PC-0N5DD4)
Synonyms:
MDL No:
Molecular Formula: C9H6F6N2O2
Molecular Weight: 288.1466

Identification/Properties


Computed Properties
Molecular Weight:
288.149g/mol
XLogP3:
2.3
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
10
Rotatable Bond Count:
3
Exact Mass:
288.033g/mol
Monoisotopic Mass:
288.033g/mol
Topological Polar Surface Area:
52.1A^2
Heavy Atom Count:
19
Formal Charge:
0
Complexity:
330
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:
H319
Precautionary Statements:
P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


Request for Quotation


Customer Feedback