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1443326-37-1

1443326-37-1 | 4-Fluoro-2-iso-pentoxythiophenol

CAS No: 1443326-37-1 Catalog No: AG01FEPN MDL No:

Product Description

Catalog Number:
AG01FEPN
Chemical Name:
4-Fluoro-2-iso-pentoxythiophenol
CAS Number:
1443326-37-1
Molecular Formula:
C11H15FOS
Molecular Weight:
214.2996
IUPAC Name:
4-fluoro-2-(3-methylbutoxy)benzenethiol
InChI:
InChI=1S/C11H15FOS/c1-8(2)5-6-13-10-7-9(12)3-4-11(10)14/h3-4,7-8,14H,5-6H2,1-2H3
InChI Key:
QVUFFUBWKCJTGC-UHFFFAOYSA-N
SMILES:
CC(CCOc1cc(F)ccc1S)C

Properties

Complexity:
163  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
214.083g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
214.298g/mol
Monoisotopic Mass:
214.083g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
10.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8  

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