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132059-53-1 | 2(5H)-Furanone, 3-bromo-4-(dibromomethyl)-5-hydroxy-
CAS No: 132059-53-1 Catalog No: AG00104X MDL No:MFCD00272647
Product Description
Catalog Number:
AG00104X
Chemical Name:
2(5H)-Furanone, 3-bromo-4-(dibromomethyl)-5-hydroxy-
CAS Number:
132059-53-1
Molecular Formula:
C5H3Br3O3
Molecular Weight:
350.7875
MDL Number:
MFCD00272647
IUPAC Name:
4-bromo-3-(dibromomethyl)-2-hydroxy-2H-furan-5-one
InChI:
InChI=1S/C5H3Br3O3/c6-2-1(3(7)8)4(9)11-5(2)10/h3-4,9H
InChI Key:
FAPCZAUMFXUDMS-UHFFFAOYSA-N
SMILES:
BrC(C1=C(Br)C(=O)OC1O)Br
Properties
Complexity:
223
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
349.761g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
350.788g/mol
Monoisotopic Mass:
347.763g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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