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161045-79-0 | Phenol, 4-bromo-2-chloro-6-fluoro-
CAS No: 161045-79-0 Catalog No: AG001VLP MDL No:MFCD01631476
Product Description
Catalog Number:
AG001VLP
Chemical Name:
Phenol, 4-bromo-2-chloro-6-fluoro-
CAS Number:
161045-79-0
Molecular Formula:
C6H3BrClFO
Molecular Weight:
225.4428
MDL Number:
MFCD01631476
IUPAC Name:
4-bromo-2-chloro-6-fluorophenol
InChI:
InChI=1S/C6H3BrClFO/c7-3-1-4(8)6(10)5(9)2-3/h1-2,10H
InChI Key:
QEYONPKSDTUPAX-UHFFFAOYSA-N
SMILES:
Brc1cc(F)c(c(c1)Cl)O
Properties
Complexity:
124
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
223.904g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
225.441g/mol
Monoisotopic Mass:
223.904g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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