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Home > Fluorides > 1250588-00-1
1250588-00-1 | 3-Fluoro-4-methylphenyl-(2-thienyl)methanol
CAS No: 1250588-00-1 Catalog No: AG01FAVY MDL No:
Product Description
Catalog Number:
AG01FAVY
Chemical Name:
3-Fluoro-4-methylphenyl-(2-thienyl)methanol
CAS Number:
1250588-00-1
Molecular Formula:
C12H11FOS
Molecular Weight:
222.2785
IUPAC Name:
(3-fluoro-4-methylthiophen-2-yl)-phenylmethanol
InChI:
InChI=1S/C12H11FOS/c1-8-7-15-12(10(8)13)11(14)9-5-3-2-4-6-9/h2-7,11,14H,1H3
InChI Key:
JOVYVZSQJSYINI-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1F)C(c1cccs1)O
Properties
Complexity:
206
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
222.051g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
222.277g/mol
Monoisotopic Mass:
222.051g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
48.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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