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1443337-91-4

1443337-91-4 | Ethyl 4-(3-bromo-6-fluoro-phenoxy)butanoate

CAS No: 1443337-91-4 Catalog No: AG01FB0I MDL No:

Product Description

Catalog Number:
AG01FB0I
Chemical Name:
Ethyl 4-(3-bromo-6-fluoro-phenoxy)butanoate
CAS Number:
1443337-91-4
Molecular Formula:
C12H14BrFO3
Molecular Weight:
305.1402
IUPAC Name:
ethyl 4-(5-bromo-2-fluorophenoxy)butanoate
InChI:
InChI=1S/C12H14BrFO3/c1-2-16-12(15)4-3-7-17-11-8-9(13)5-6-10(11)14/h5-6,8H,2-4,7H2,1H3
InChI Key:
VDCCZYSXLRJYOQ-UHFFFAOYSA-N
SMILES:
CCOC(=O)CCCOc1cc(Br)ccc1F

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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