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1443346-00-6 | 1-[3-Fluoro-4-(trifluoromethoxy)phenyl]ethanol
CAS No: 1443346-00-6 Catalog No: AG01EU41 MDL No:
Product Description
Catalog Number:
AG01EU41
Chemical Name:
1-[3-Fluoro-4-(trifluoromethoxy)phenyl]ethanol
CAS Number:
1443346-00-6
Molecular Formula:
C9H8F4O2
Molecular Weight:
224.1522
IUPAC Name:
1-[3-fluoro-4-(trifluoromethoxy)phenyl]ethanol
InChI:
InChI=1S/C9H8F4O2/c1-5(14)6-2-3-8(7(10)4-6)15-9(11,12)13/h2-5,14H,1H3
InChI Key:
DSYXSWQQAWPYHN-UHFFFAOYSA-N
SMILES:
Fc1cc(ccc1OC(F)(F)F)C(O)C
Properties
Complexity:
207
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
224.046g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
224.155g/mol
Monoisotopic Mass:
224.046g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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