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Home > Bromides > 1228956-98-6
1228956-98-6 | Phenol, 6-bromo-2-fluoro-3-(phenylmethoxy)-
CAS No: 1228956-98-6 Catalog No: AG000JQK MDL No:MFCD16618956
Product Description
Catalog Number:
AG000JQK
Chemical Name:
Phenol, 6-bromo-2-fluoro-3-(phenylmethoxy)-
CAS Number:
1228956-98-6
Molecular Formula:
C13H10BrFO2
Molecular Weight:
297.1197
MDL Number:
MFCD16618956
IUPAC Name:
6-bromo-2-fluoro-3-phenylmethoxyphenol
InChI:
InChI=1S/C13H10BrFO2/c14-10-6-7-11(12(15)13(10)16)17-8-9-4-2-1-3-5-9/h1-7,16H,8H2
InChI Key:
WDWMIQICZJPVHB-UHFFFAOYSA-N
SMILES:
Brc1ccc(c(c1O)F)OCc1ccccc1
Properties
Complexity:
234
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
295.985g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
297.123g/mol
Monoisotopic Mass:
295.985g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8
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