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Home > Bromides > 1233513-01-3
1233513-01-3 | 2-Bromo-4,6-difluorobenzenesulfinic acid sodium salt
CAS No: 1233513-01-3 Catalog No: AG01F8FF MDL No:
Product Description
Catalog Number:
AG01F8FF
Chemical Name:
2-Bromo-4,6-difluorobenzenesulfinic acid sodium salt
CAS Number:
1233513-01-3
Molecular Formula:
C6H2BrF2NaO2S
Molecular Weight:
279.0345
IUPAC Name:
sodium;2-bromo-4,6-difluorobenzenesulfinate
InChI:
InChI=1S/C6H3BrF2O2S.Na/c7-4-1-3(8)2-5(9)6(4)12(10)11;/h1-2H,(H,10,11);/q;+1/p-1
InChI Key:
WIDDPRLSHOVEHH-UHFFFAOYSA-M
SMILES:
Fc1cc(F)c(c(c1)Br)S(=O)[O-].[Na+]
Properties
Complexity:
198
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
277.882g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
279.031g/mol
Monoisotopic Mass:
277.882g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
59.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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