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876861-29-9 | 5-Bromo-3-fluorobenzene-1,2-diol
CAS No: 876861-29-9 Catalog No: AG004GXO MDL No:MFCD19441229
Product Description
Catalog Number:
AG004GXO
Chemical Name:
5-Bromo-3-fluorobenzene-1,2-diol
CAS Number:
876861-29-9
Molecular Formula:
C6H4BrFO2
Molecular Weight:
206.9972
MDL Number:
MFCD19441229
IUPAC Name:
5-bromo-3-fluorobenzene-1,2-diol
InChI:
InChI=1S/C6H4BrFO2/c7-3-1-4(8)6(10)5(9)2-3/h1-2,9-10H
InChI Key:
NTMLYGHAJRXVMB-UHFFFAOYSA-N
SMILES:
Brc1cc(O)c(c(c1)F)O
Properties
Complexity:
122
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
205.938g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
206.998g/mol
Monoisotopic Mass:
205.938g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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