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1443330-51-5 | 5-Fluoro-3-iso-pentoxybenzyl alcohol
CAS No: 1443330-51-5 Catalog No: AG01FDKY MDL No:
Product Description
Catalog Number:
AG01FDKY
Chemical Name:
5-Fluoro-3-iso-pentoxybenzyl alcohol
CAS Number:
1443330-51-5
Molecular Formula:
C12H17FO2
Molecular Weight:
212.2606
IUPAC Name:
[3-fluoro-5-(3-methylbutoxy)phenyl]methanol
InChI:
InChI=1S/C12H17FO2/c1-9(2)3-4-15-12-6-10(8-14)5-11(13)7-12/h5-7,9,14H,3-4,8H2,1-2H3
InChI Key:
SJIAQBWSFPJKHL-UHFFFAOYSA-N
SMILES:
OCc1cc(OCCC(C)C)cc(c1)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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