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Home > Bromides > 1443345-14-9
1443345-14-9 | Ethyl 5-(3-bromo-5,6-difluoro-phenoxy)pentanoate
CAS No: 1443345-14-9 Catalog No: AG01F9LM MDL No:
Product Description
Catalog Number:
AG01F9LM
Chemical Name:
Ethyl 5-(3-bromo-5,6-difluoro-phenoxy)pentanoate
CAS Number:
1443345-14-9
Molecular Formula:
C13H15BrF2O3
Molecular Weight:
337.1572
IUPAC Name:
ethyl 5-(5-bromo-2,3-difluorophenoxy)pentanoate
InChI:
InChI=1S/C13H15BrF2O3/c1-2-18-12(17)5-3-4-6-19-11-8-9(14)7-10(15)13(11)16/h7-8H,2-6H2,1H3
InChI Key:
BWNMMKRLVAVNJG-UHFFFAOYSA-N
SMILES:
CCOC(=O)CCCCOc1cc(Br)cc(c1F)F
Properties
Complexity:
279
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
336.017g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
337.161g/mol
Monoisotopic Mass:
336.017g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
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