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83629-87-2 | 2,3-Furandione, 4-bromo-5-phenyl-
CAS No: 83629-87-2 Catalog No: AG0056VP MDL No:
Product Description
Catalog Number:
AG0056VP
Chemical Name:
2,3-Furandione, 4-bromo-5-phenyl-
CAS Number:
83629-87-2
Molecular Formula:
C10H5BrO3
Molecular Weight:
253.0489
IUPAC Name:
4-bromo-5-phenylfuran-2,3-dione
InChI:
InChI=1S/C10H5BrO3/c11-7-8(12)10(13)14-9(7)6-4-2-1-3-5-6/h1-5H
InChI Key:
HUVRFMDSOJPXRG-UHFFFAOYSA-N
SMILES:
O=C1C(=O)OC(=C1Br)c1ccccc1
Properties
Complexity:
313
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
251.942g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
253.051g/mol
Monoisotopic Mass:
251.942g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
43.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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