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24581-99-5 | METHYL (4-BROMO-2-FORMYLPHENOXY)ACETATE
CAS No: 24581-99-5 Catalog No: AG007MO1 MDL No:MFCD02629616
Product Description
Catalog Number:
AG007MO1
Chemical Name:
METHYL (4-BROMO-2-FORMYLPHENOXY)ACETATE
CAS Number:
24581-99-5
Molecular Formula:
C10H9BrO4
Molecular Weight:
273.0801
MDL Number:
MFCD02629616
IUPAC Name:
methyl 2-(4-bromo-2-formylphenoxy)acetate
InChI:
InChI=1S/C10H9BrO4/c1-14-10(13)6-15-9-3-2-8(11)4-7(9)5-12/h2-5H,6H2,1H3
InChI Key:
BGCBNZCJIJRUAY-UHFFFAOYSA-N
SMILES:
COC(=O)COc1ccc(cc1C=O)Br
Properties
Complexity:
232
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
271.968g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
273.082g/mol
Monoisotopic Mass:
271.968g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
52.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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