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1339583-76-4

1339583-76-4 | 3-Fluoro-6-methylphenyl-(5-methyl-2-thienyl)methanol

CAS No: 1339583-76-4 Catalog No: AG01F8GZ MDL No:

Product Description

Catalog Number:
AG01F8GZ
Chemical Name:
3-Fluoro-6-methylphenyl-(5-methyl-2-thienyl)methanol
CAS Number:
1339583-76-4
Molecular Formula:
C13H13FOS
Molecular Weight:
236.3051
IUPAC Name:
(3-fluoro-5-methylthiophen-2-yl)-(2-methylphenyl)methanol
InChI:
InChI=1S/C13H13FOS/c1-8-5-3-4-6-10(8)12(15)13-11(14)7-9(2)16-13/h3-7,12,15H,1-2H3
InChI Key:
VVGGEDNHHYNAOR-UHFFFAOYSA-N
SMILES:
Fc1ccc(c(c1)C(c1ccc(s1)C)O)C

Properties

Complexity:
236  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
236.067g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
236.304g/mol
Monoisotopic Mass:
236.067g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
48.5A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3  

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