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113485-19-1 | Acetic acid, 2-[(3,5,6-trichloro-2-pyridinyl)oxy]-, 1-methylethyl ester
CAS No: 113485-19-1 Catalog No: AG0008Q7 MDL No:
Product Description
Catalog Number:
AG0008Q7
Chemical Name:
Acetic acid, 2-[(3,5,6-trichloro-2-pyridinyl)oxy]-, 1-methylethyl ester
CAS Number:
113485-19-1
Molecular Formula:
C10H10Cl3NO3
Molecular Weight:
298.5503
IUPAC Name:
propan-2-yl 2-(3,5,6-trichloropyridin-2-yl)oxyacetate
InChI:
InChI=1S/C10H10Cl3NO3/c1-5(2)17-8(15)4-16-10-7(12)3-6(11)9(13)14-10/h3,5H,4H2,1-2H3
InChI Key:
YYDIWNJRCPIVPY-UHFFFAOYSA-N
SMILES:
CC(OC(=O)COc1nc(Cl)c(cc1Cl)Cl)C
Properties
Complexity:
265
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
296.973g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
298.544g/mol
Monoisotopic Mass:
296.973g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
48.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1
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