Home Halogens methyl 4-(4-bromophenyl)-2-hydroxy-4-oxobut-2-enoate

methyl 4-(4-bromophenyl)-2-hydroxy-4-oxobut-2-enoate

CAS No.:
39847-97-7
Catalog Number:
AG01C4NF
Molecular Formula:
C11H9BrO4
Molecular Weight:
285.0908
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Product Description
Catalog Number:
AG01C4NF
Chemical Name:
methyl 4-(4-bromophenyl)-2-hydroxy-4-oxobut-2-enoate
CAS Number:
39847-97-7
Molecular Formula:
C11H9BrO4
Molecular Weight:
285.0908
MDL Number:
MFCD06740811
IUPAC Name:
methyl 4-(4-bromophenyl)-4-hydroxy-2-oxobut-3-enoate
InChI:
InChI=1S/C11H9BrO4/c1-16-11(15)10(14)6-9(13)7-2-4-8(12)5-3-7/h2-6,13H,1H3
InChI Key:
VVXPHNFANFKOJY-UHFFFAOYSA-N
SMILES:
COC(=O)C(=CC(=O)c1ccc(cc1)Br)O
Properties
Complexity:
303  
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:
1  
Isotope Atom Count:
0
Molecular Weight:
285.093g/mol
Monoisotopic Mass:
283.968g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
63.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1  
XLogP3:
2.8  
Properties