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1443328-34-4 | O2-Ethyl O1-[2-(3,4,5-trifluorophenyl)ethyl] oxalate
CAS No: 1443328-34-4 Catalog No: AG01F8JZ MDL No:
Product Description
Catalog Number:
AG01F8JZ
Chemical Name:
O2-Ethyl O1-[2-(3,4,5-trifluorophenyl)ethyl] oxalate
CAS Number:
1443328-34-4
Molecular Formula:
C12H11F3O4
Molecular Weight:
276.2085
IUPAC Name:
1-O-ethyl 2-O-[2-(3,4,5-trifluorophenyl)ethyl] oxalate
InChI:
InChI=1S/C12H11F3O4/c1-2-18-11(16)12(17)19-4-3-7-5-8(13)10(15)9(14)6-7/h5-6H,2-4H2,1H3
InChI Key:
GLMANVXPMVNNSW-UHFFFAOYSA-N
SMILES:
CCOC(=O)C(=O)OCCc1cc(F)c(c(c1)F)F
Properties
Complexity:
312
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
276.061g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
276.211g/mol
Monoisotopic Mass:
276.061g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
52.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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