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Home > Bromides > 1443329-62-1
1443329-62-1 | Ethyl 4-(2-bromo-5-fluoro-phenoxy)butanoate
CAS No: 1443329-62-1 Catalog No: AG01FB06 MDL No:
Product Description
Catalog Number:
AG01FB06
Chemical Name:
Ethyl 4-(2-bromo-5-fluoro-phenoxy)butanoate
CAS Number:
1443329-62-1
Molecular Formula:
C12H14BrFO3
Molecular Weight:
305.1402
IUPAC Name:
ethyl 4-(2-bromo-5-fluorophenoxy)butanoate
InChI:
InChI=1S/C12H14BrFO3/c1-2-16-12(15)4-3-7-17-11-8-9(14)5-6-10(11)13/h5-6,8H,2-4,7H2,1H3
InChI Key:
ZOTLBDTUCKWHAS-UHFFFAOYSA-N
SMILES:
CCOC(=O)CCCOc1cc(F)ccc1Br
Properties
Complexity:
238
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
304.011g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
305.143g/mol
Monoisotopic Mass:
304.011g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
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