4-Pyrimidinecarboxylic acid, 6-chloro-2-methyl-, ethyl ester


Chemical Name: 4-Pyrimidinecarboxylic acid, 6-chloro-2-methyl-, ethyl ester
CAS Number: 744253-37-0
Product Number: AG00FFC4(AGN-PC-0JF473)
Synonyms:
MDL No:
Molecular Formula: C8H9ClN2O2
Molecular Weight: 200.62226

Identification/Properties


Computed Properties
Molecular Weight:
200.622g/mol
XLogP3:
2.1
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
3
Exact Mass:
200.035g/mol
Monoisotopic Mass:
200.035g/mol
Topological Polar Surface Area:
52.1A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
189
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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