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1443344-26-0 | Methyl 2-(trifluoromethoxy)benzoylformate
CAS No: 1443344-26-0 Catalog No: AG01FBOG MDL No:
Product Description
Catalog Number:
AG01FBOG
Chemical Name:
Methyl 2-(trifluoromethoxy)benzoylformate
CAS Number:
1443344-26-0
Molecular Formula:
C10H7F3O4
Molecular Weight:
248.1554
IUPAC Name:
methyl 2-oxo-2-[2-(trifluoromethoxy)phenyl]acetate
InChI:
InChI=1S/C10H7F3O4/c1-16-9(15)8(14)6-4-2-3-5-7(6)17-10(11,12)13/h2-5H,1H3
InChI Key:
PSKQHPIPGCGWCH-UHFFFAOYSA-N
SMILES:
COC(=O)C(=O)c1ccccc1OC(F)(F)F
Properties
Complexity:
300
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
248.03g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
248.157g/mol
Monoisotopic Mass:
248.03g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
52.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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