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1095085-20-3 | 3-Fluoro-4-n-pentoxybenzyl alcohol
CAS No: 1095085-20-3 Catalog No: AG01FE1O MDL No:
Product Description
Catalog Number:
AG01FE1O
Chemical Name:
3-Fluoro-4-n-pentoxybenzyl alcohol
CAS Number:
1095085-20-3
Molecular Formula:
C12H17FO2
Molecular Weight:
212.2606
IUPAC Name:
(3-fluoro-4-pentoxyphenyl)methanol
InChI:
InChI=1S/C12H17FO2/c1-2-3-4-7-15-12-6-5-10(9-14)8-11(12)13/h5-6,8,14H,2-4,7,9H2,1H3
InChI Key:
BVHVQEAYVRZFRH-UHFFFAOYSA-N
SMILES:
CCCCCOc1ccc(cc1F)CO
Properties
Complexity:
164
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:
6
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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