Home Other Building Blocks METHYL 3-BROMO-2,4-DIOXO-4-PHENYLBUTANOATE

METHYL 3-BROMO-2,4-DIOXO-4-PHENYLBUTANOATE

CAS No.:
59609-59-5
Catalog Number:
AG00EDZ9
Molecular Formula:
C11H9BrO4
Molecular Weight:
285.0908
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Product Description
Catalog Number:
AG00EDZ9
Chemical Name:
METHYL 3-BROMO-2,4-DIOXO-4-PHENYLBUTANOATE
CAS Number:
59609-59-5
Molecular Formula:
C11H9BrO4
Molecular Weight:
285.0908
MDL Number:
MFCD00573907
IUPAC Name:
methyl 3-bromo-2,4-dioxo-4-phenylbutanoate
InChI:
InChI=1S/C11H9BrO4/c1-16-11(15)10(14)8(12)9(13)7-5-3-2-4-6-7/h2-6,8H,1H3
InChI Key:
ZLWZFMIPUOKDJU-UHFFFAOYSA-N
SMILES:
COC(=O)C(=O)C(C(=O)c1ccccc1)Br
Properties
Complexity:
294  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
283.968g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
285.093g/mol
Monoisotopic Mass:
283.968g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
60.4A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  
Properties