Home Halogens methyl 3-bromo-4-(2-methoxy-2-oxoethyl)benzoate

methyl 3-bromo-4-(2-methoxy-2-oxoethyl)benzoate

CAS No.:
1069114-91-5
Catalog Number:
AG01B1EU
Molecular Formula:
C11H11BrO4
Molecular Weight:
287.1066
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Product Description
Catalog Number:
AG01B1EU
Chemical Name:
methyl 3-bromo-4-(2-methoxy-2-oxoethyl)benzoate
CAS Number:
1069114-91-5
Molecular Formula:
C11H11BrO4
Molecular Weight:
287.1066
MDL Number:
MFCD27959528
IUPAC Name:
methyl 3-bromo-4-(2-methoxy-2-oxoethyl)benzoate
InChI:
InChI=1S/C11H11BrO4/c1-15-10(13)6-7-3-4-8(5-9(7)12)11(14)16-2/h3-5H,6H2,1-2H3
InChI Key:
RISSVGMDPORMGD-UHFFFAOYSA-N
SMILES:
COC(=O)Cc1ccc(cc1Br)C(=O)OC
Properties
Complexity:
267  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
285.984g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
287.109g/mol
Monoisotopic Mass:
285.984g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
52.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  
Properties