Home Halogens ethyl 2-(2-bromo-6-formyl-4-methylphenoxy)acetate

ethyl 2-(2-bromo-6-formyl-4-methylphenoxy)acetate

CAS No.:
1461707-80-1
Catalog Number:
AG01A5OY
Molecular Formula:
C12H13BrO4
Molecular Weight:
301.1332
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Product Description
Catalog Number:
AG01A5OY
Chemical Name:
ethyl 2-(2-bromo-6-formyl-4-methylphenoxy)acetate
CAS Number:
1461707-80-1
Molecular Formula:
C12H13BrO4
Molecular Weight:
301.1332
MDL Number:
MFCD25371607
IUPAC Name:
ethyl 2-(2-bromo-6-formyl-4-methylphenoxy)acetate
InChI:
InChI=1S/C12H13BrO4/c1-3-16-11(15)7-17-12-9(6-14)4-8(2)5-10(12)13/h4-6H,3,7H2,1-2H3
InChI Key:
VAKMHZJXRJMYHT-UHFFFAOYSA-N
SMILES:
CCOC(=O)COc1c(Br)cc(cc1C=O)C
Properties
Complexity:
269  
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:
6  
Topological Polar Surface Area:
52.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7  
Properties