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Home > Fluorides > 1249959-68-9
1249959-68-9 | 3-Fluoro-6-methoxyphenyl-(3-thienyl)methanol
CAS No: 1249959-68-9 Catalog No: AG01FALJ MDL No:
Product Description
Catalog Number:
AG01FALJ
Chemical Name:
3-Fluoro-6-methoxyphenyl-(3-thienyl)methanol
CAS Number:
1249959-68-9
Molecular Formula:
C12H11FO2S
Molecular Weight:
238.2779
IUPAC Name:
(5-fluoro-2-methoxyphenyl)-thiophen-3-ylmethanol
InChI:
InChI=1S/C12H11FO2S/c1-15-11-3-2-9(13)6-10(11)12(14)8-4-5-16-7-8/h2-7,12,14H,1H3
InChI Key:
COWBNNDXIZTRSC-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1C(c1ccsc1)O)F
Properties
Complexity:
227
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
238.046g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
238.276g/mol
Monoisotopic Mass:
238.046g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
57.7A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
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