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Home > Fluorides > 1340506-53-7
1340506-53-7 | 4-Fluoro-3-methylphenyl-(3-thienyl)methanol
CAS No: 1340506-53-7 Catalog No: AG01FAX3 MDL No:
Product Description
Catalog Number:
AG01FAX3
Chemical Name:
4-Fluoro-3-methylphenyl-(3-thienyl)methanol
CAS Number:
1340506-53-7
Molecular Formula:
C12H11FOS
Molecular Weight:
222.2785
IUPAC Name:
(4-fluoro-3-methylphenyl)-thiophen-3-ylmethanol
InChI:
InChI=1S/C12H11FOS/c1-8-6-9(2-3-11(8)13)12(14)10-4-5-15-7-10/h2-7,12,14H,1H3
InChI Key:
RTBHOLJDODKZMJ-UHFFFAOYSA-N
SMILES:
Fc1ccc(cc1C)C(c1cscc1)O
Properties
Complexity:
212
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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