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Home > Bromides > 1389264-29-2
1389264-29-2 | 4,7-Benzofurandione, 2-acetyl-5-bromo-
CAS No: 1389264-29-2 Catalog No: AG0019VA MDL No:MFCD22415257
Product Description
Catalog Number:
AG0019VA
Chemical Name:
4,7-Benzofurandione, 2-acetyl-5-bromo-
CAS Number:
1389264-29-2
Molecular Formula:
C10H5BrO4
Molecular Weight:
269.0483
MDL Number:
MFCD22415257
IUPAC Name:
2-acetyl-5-bromo-1-benzofuran-4,7-dione
InChI:
InChI=1S/C10H5BrO4/c1-4(12)8-2-5-9(14)6(11)3-7(13)10(5)15-8/h2-3H,1H3
InChI Key:
KDVZWDYCCQHJPF-UHFFFAOYSA-N
SMILES:
CC(=O)c1oc2c(c1)C(=O)C(=CC2=O)Br
Properties
Complexity:
385
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
267.937g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
269.05g/mol
Monoisotopic Mass:
267.937g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
64.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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