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162744-59-4 | Benzenemethanol, 4-bromo-2,6-difluoro-
CAS No: 162744-59-4 Catalog No: AG001TEI MDL No:MFCD03094461
Product Description
Catalog Number:
AG001TEI
Chemical Name:
Benzenemethanol, 4-bromo-2,6-difluoro-
CAS Number:
162744-59-4
Molecular Formula:
C7H5BrF2O
Molecular Weight:
223.0148
MDL Number:
MFCD03094461
IUPAC Name:
(4-bromo-2,6-difluorophenyl)methanol
InChI:
InChI=1S/C7H5BrF2O/c8-4-1-6(9)5(3-11)7(10)2-4/h1-2,11H,3H2
InChI Key:
LSRHFWSNUFIKER-UHFFFAOYSA-N
SMILES:
OCc1c(F)cc(cc1F)Br
Properties
Complexity:
122
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
221.949g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
223.017g/mol
Monoisotopic Mass:
221.949g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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