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Home > Bromides > 1253189-03-5
1253189-03-5 | Benzenemethanol, 2-bromo-6-(trifluoromethoxy)-
CAS No: 1253189-03-5 Catalog No: AG000NH8 MDL No:MFCD22375105
Product Description
Catalog Number:
AG000NH8
Chemical Name:
Benzenemethanol, 2-bromo-6-(trifluoromethoxy)-
CAS Number:
1253189-03-5
Molecular Formula:
C8H6BrF3O2
Molecular Weight:
271.0312
MDL Number:
MFCD22375105
IUPAC Name:
[2-bromo-6-(trifluoromethoxy)phenyl]methanol
InChI:
InChI=1S/C8H6BrF3O2/c9-6-2-1-3-7(5(6)4-13)14-8(10,11)12/h1-3,13H,4H2
InChI Key:
DTDOTSMDADDJEH-UHFFFAOYSA-N
SMILES:
OCc1c(cccc1Br)OC(F)(F)F
Properties
Complexity:
186
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
269.95g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
271.033g/mol
Monoisotopic Mass:
269.95g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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