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Home > Bromides > 1349718-58-6
1349718-58-6 | 3-Bromo-2,5-difluorobenzenethiol
CAS No: 1349718-58-6 Catalog No: AG01FENX MDL No:MFCD20233335
Product Description
Catalog Number:
AG01FENX
Chemical Name:
3-Bromo-2,5-difluorobenzenethiol
CAS Number:
1349718-58-6
Molecular Formula:
C6H3BrF2S
Molecular Weight:
225.0538
MDL Number:
MFCD20233335
IUPAC Name:
3-bromo-2,5-difluorobenzenethiol
InChI:
InChI=1S/C6H3BrF2S/c7-4-1-3(8)2-5(10)6(4)9/h1-2,10H
InChI Key:
CDKKDLURIHBIJB-UHFFFAOYSA-N
SMILES:
Fc1cc(S)c(c(c1)Br)F
Properties
Complexity:
122
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
223.911g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
225.051g/mol
Monoisotopic Mass:
223.911g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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