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Home > Bromides > 1443336-51-3
1443336-51-3 | Ethyl 3-(4-bromo-2-formylphenoxy)propanoate
CAS No: 1443336-51-3 Catalog No: AG01FB0D MDL No:
Product Description
Catalog Number:
AG01FB0D
Chemical Name:
Ethyl 3-(4-bromo-2-formylphenoxy)propanoate
CAS Number:
1443336-51-3
Molecular Formula:
C12H13BrO4
Molecular Weight:
301.1332
IUPAC Name:
ethyl 3-(4-bromo-2-formylphenoxy)propanoate
InChI:
InChI=1S/C12H13BrO4/c1-2-16-12(15)5-6-17-11-4-3-10(13)7-9(11)8-14/h3-4,7-8H,2,5-6H2,1H3
InChI Key:
FLPQMRLDBVYQGS-UHFFFAOYSA-N
SMILES:
CCOC(=O)CCOc1ccc(cc1C=O)Br
Properties
Complexity:
257
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
300g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
301.136g/mol
Monoisotopic Mass:
300g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
52.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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