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83629-89-4 | 2,3-Furandione, 4-bromo-5-(4-methoxyphenyl)-
CAS No: 83629-89-4 Catalog No: AG004TSM MDL No:
Product Description
Catalog Number:
AG004TSM
Chemical Name:
2,3-Furandione, 4-bromo-5-(4-methoxyphenyl)-
CAS Number:
83629-89-4
Molecular Formula:
C11H7BrO4
Molecular Weight:
283.0749
IUPAC Name:
4-bromo-5-(4-methoxyphenyl)furan-2,3-dione
InChI:
InChI=1S/C11H7BrO4/c1-15-7-4-2-6(3-5-7)10-8(12)9(13)11(14)16-10/h2-5H,1H3
InChI Key:
CACUJNOSIOLWQJ-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)C1=C(Br)C(=O)C(=O)O1
Properties
Complexity:
353
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
281.953g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
283.077g/mol
Monoisotopic Mass:
281.953g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
52.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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