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1443350-25-1 | Ethyl 5-fluoro-3-n-propoxybenzoylformate
CAS No: 1443350-25-1 Catalog No: AG01FC34 MDL No:
Product Description
Catalog Number:
AG01FC34
Chemical Name:
Ethyl 5-fluoro-3-n-propoxybenzoylformate
CAS Number:
1443350-25-1
Molecular Formula:
C13H15FO4
Molecular Weight:
254.2542
IUPAC Name:
ethyl 2-(3-fluoro-5-propoxyphenyl)-2-oxoacetate
InChI:
InChI=1S/C13H15FO4/c1-3-5-18-11-7-9(6-10(14)8-11)12(15)13(16)17-4-2/h6-8H,3-5H2,1-2H3
InChI Key:
GUTPQOVBNMQCGX-UHFFFAOYSA-N
SMILES:
CCCOc1cc(F)cc(c1)C(=O)C(=O)OCC
Properties
Complexity:
293
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
254.095g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
254.257g/mol
Monoisotopic Mass:
254.095g/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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