methyl 2-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]acetate


Chemical Name: methyl 2-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]acetate
CAS Number: 885949-63-3
Product Number: AG00IF7V(AGN-PC-0KKPQJ)
Synonyms:
MDL No:
Molecular Formula: C9H7ClF3NO2
Molecular Weight: 253.6056

Identification/Properties


Computed Properties
Molecular Weight:
253.605g/mol
XLogP3:
2.2
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
6
Rotatable Bond Count:
3
Exact Mass:
253.012g/mol
Monoisotopic Mass:
253.012g/mol
Topological Polar Surface Area:
39.2A^2
Heavy Atom Count:
16
Formal Charge:
0
Complexity:
260
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:
N/A
Signal Word:
UN#:
-
Hazard Statements:
-
Precautionary Statements:
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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