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Home > Bromides > 1443334-23-3
1443334-23-3 | Ethyl 4-(4-bromo-2,5-difluoro-phenoxy)butanoate
CAS No: 1443334-23-3 Catalog No: AG01F9VS MDL No:
Product Description
Catalog Number:
AG01F9VS
Chemical Name:
Ethyl 4-(4-bromo-2,5-difluoro-phenoxy)butanoate
CAS Number:
1443334-23-3
Molecular Formula:
C12H13BrF2O3
Molecular Weight:
323.1306
IUPAC Name:
ethyl 4-(4-bromo-2,5-difluorophenoxy)butanoate
InChI:
InChI=1S/C12H13BrF2O3/c1-2-17-12(16)4-3-5-18-11-7-9(14)8(13)6-10(11)15/h6-7H,2-5H2,1H3
InChI Key:
MTRYNNKQVLMHCO-UHFFFAOYSA-N
SMILES:
CCOC(=O)CCCOc1cc(F)c(cc1F)Br
Properties
Complexity:
266
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
322.002g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
323.134g/mol
Monoisotopic Mass:
322.002g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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