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1443347-26-9 | 4-Fluoro-2-iso-pentoxybenzyl alcohol
CAS No: 1443347-26-9 Catalog No: AG01FDM2 MDL No:
Product Description
Catalog Number:
AG01FDM2
Chemical Name:
4-Fluoro-2-iso-pentoxybenzyl alcohol
CAS Number:
1443347-26-9
Molecular Formula:
C12H17FO2
Molecular Weight:
212.2606
IUPAC Name:
[4-fluoro-2-(3-methylbutoxy)phenyl]methanol
InChI:
InChI=1S/C12H17FO2/c1-9(2)5-6-15-12-7-11(13)4-3-10(12)8-14/h3-4,7,9,14H,5-6,8H2,1-2H3
InChI Key:
WCASZMTUPKHEKG-UHFFFAOYSA-N
SMILES:
OCc1ccc(cc1OCCC(C)C)F
Properties
Complexity:
173
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
212.121g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
212.264g/mol
Monoisotopic Mass:
212.121g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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