5-Pyrimidinecarboxylic acid, 4-chloro-2-phenyl-, ethyl ester


Chemical Name: 5-Pyrimidinecarboxylic acid, 4-chloro-2-phenyl-, ethyl ester
CAS Number: 24755-82-6
Product Number: AG002PB7(AGN-PC-0JOEUG)
Synonyms:
MDL No:
Molecular Formula: C13H11ClN2O2
Molecular Weight: 262.6916

Identification/Properties


Computed Properties
Molecular Weight:
262.693g/mol
XLogP3:
3
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
4
Exact Mass:
262.051g/mol
Monoisotopic Mass:
262.051g/mol
Topological Polar Surface Area:
52.1A^2
Heavy Atom Count:
18
Formal Charge:
0
Complexity:
282
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:
P264-P302+P352-P304+P340-P305+P351+P338-P332+P313-P337+P313
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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