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1454847-96-1 | Benzenemethanol, 5-fluoro-2-iodo-α-methyl-, (αS)-
CAS No: 1454847-96-1 Catalog No: AG001D3F MDL No:
Product Description
Catalog Number:
AG001D3F
Chemical Name:
Benzenemethanol, 5-fluoro-2-iodo-α-methyl-, (αS)-
CAS Number:
1454847-96-1
Molecular Formula:
C8H8FIO
Molecular Weight:
266.0514
IUPAC Name:
(1S)-1-(5-fluoro-2-iodophenyl)ethanol
InChI:
InChI=1S/C8H8FIO/c1-5(11)7-4-6(9)2-3-8(7)10/h2-5,11H,1H3/t5-/m0/s1
InChI Key:
GQGBQRLYBYFVAW-YFKPBYRVSA-N
SMILES:
Fc1ccc(c(c1)[C@@H](O)C)I
Properties
Complexity:
131
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
265.96g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
266.054g/mol
Monoisotopic Mass:
265.96g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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