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1443326-90-6 | Methyl 2-(3,4-difluorobenzoyl)benzoate
CAS No: 1443326-90-6 Catalog No: AG01FCQY MDL No:
Product Description
Catalog Number:
AG01FCQY
Chemical Name:
Methyl 2-(3,4-difluorobenzoyl)benzoate
CAS Number:
1443326-90-6
Molecular Formula:
C15H10F2O3
Molecular Weight:
276.2349
IUPAC Name:
methyl 2-(3,4-difluorobenzoyl)benzoate
InChI:
InChI=1S/C15H10F2O3/c1-20-15(19)11-5-3-2-4-10(11)14(18)9-6-7-12(16)13(17)8-9/h2-8H,1H3
InChI Key:
IQZLNARQEJRAMS-UHFFFAOYSA-N
SMILES:
COC(=O)c1ccccc1C(=O)c1ccc(c(c1)F)F
Properties
Complexity:
372
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
276.06g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
276.239g/mol
Monoisotopic Mass:
276.06g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
43.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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