Home Halogens ethyl 5-bromo-4-fluoro-2-methylbenzoate

ethyl 5-bromo-4-fluoro-2-methylbenzoate

CAS No.:
1564543-52-7
Catalog Number:
AG01B9GG
Molecular Formula:
C10H10BrFO2
Molecular Weight:
261.0876
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Product Description
Catalog Number:
AG01B9GG
Chemical Name:
ethyl 5-bromo-4-fluoro-2-methylbenzoate
CAS Number:
1564543-52-7
Molecular Formula:
C10H10BrFO2
Molecular Weight:
261.0876
MDL Number:
MFCD26863046
IUPAC Name:
ethyl 5-bromo-4-fluoro-2-methylbenzoate
InChI:
InChI=1S/C10H10BrFO2/c1-3-14-10(13)7-5-8(11)9(12)4-6(7)2/h4-5H,3H2,1-2H3
InChI Key:
ALPDZZBGNONNMI-UHFFFAOYSA-N
SMILES:
Cc1cc(F)c(cc1C(=O)OCC)Br
Properties
Complexity:
210  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
259.985g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
261.09g/mol
Monoisotopic Mass:
259.985g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3  
Properties