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Home > Fluorides > 1443306-97-5
1443306-97-5 | Ethyl 3-fluoro-4-iso-pentoxybenzoylformate
CAS No: 1443306-97-5 Catalog No: AG01FBB1 MDL No:
Product Description
Catalog Number:
AG01FBB1
Chemical Name:
Ethyl 3-fluoro-4-iso-pentoxybenzoylformate
CAS Number:
1443306-97-5
Molecular Formula:
C15H19FO4
Molecular Weight:
282.3074
IUPAC Name:
ethyl 2-[3-fluoro-4-(3-methylbutoxy)phenyl]-2-oxoacetate
InChI:
InChI=1S/C15H19FO4/c1-4-19-15(18)14(17)11-5-6-13(12(16)9-11)20-8-7-10(2)3/h5-6,9-10H,4,7-8H2,1-3H3
InChI Key:
PNUOHDQZXJDYRA-UHFFFAOYSA-N
SMILES:
CCOC(=O)C(=O)c1ccc(c(c1)F)OCCC(C)C
Properties
Complexity:
330
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
282.127g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
282.311g/mol
Monoisotopic Mass:
282.127g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
52.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8
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