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1249504-55-9

1249504-55-9 | 3,5-Difluorophenyl-(2-thienyl)methanol

CAS No: 1249504-55-9 Catalog No: AG01FCL3 MDL No:

Product Description

Catalog Number:
AG01FCL3
Chemical Name:
3,5-Difluorophenyl-(2-thienyl)methanol
CAS Number:
1249504-55-9
Molecular Formula:
C11H8F2OS
Molecular Weight:
226.2424
IUPAC Name:
(3,5-difluorophenyl)-thiophen-2-ylmethanol
InChI:
InChI=1S/C11H8F2OS/c12-8-4-7(5-9(13)6-8)11(14)10-2-1-3-15-10/h1-6,11,14H
InChI Key:
ZUORCFAKYYHENT-UHFFFAOYSA-N
SMILES:
Fc1cc(cc(c1)F)C(c1cccs1)O

Properties

Complexity:
205  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
226.026g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
226.241g/mol
Monoisotopic Mass:
226.026g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
48.5A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6  

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