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Home > Fluorides > 1339055-65-0
1339055-65-0 | 2-(3-fluoro-4-methoxyphenyl)butan-2-ol
CAS No: 1339055-65-0 Catalog No: AG00OIQM MDL No:MFCD17223921
Product Description
Catalog Number:
AG00OIQM
Chemical Name:
2-(3-fluoro-4-methoxyphenyl)butan-2-ol
CAS Number:
1339055-65-0
Molecular Formula:
C11H15FO2
Molecular Weight:
198.2340
MDL Number:
MFCD17223921
IUPAC Name:
2-(3-fluoro-4-methoxyphenyl)butan-2-ol
InChI:
InChI=1S/C11H15FO2/c1-4-11(2,13)8-5-6-10(14-3)9(12)7-8/h5-7,13H,4H2,1-3H3
InChI Key:
PIBKMFLNADEMAV-UHFFFAOYSA-N
SMILES:
CCC(c1ccc(c(c1)F)OC)(O)C
Properties
Complexity:
186
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
198.106g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
198.237g/mol
Monoisotopic Mass:
198.106g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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