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1443311-43-0 | 4-Fluoro-2-n-pentoxythiophenol
CAS No: 1443311-43-0 Catalog No: AG01FF2K MDL No:
Product Description
Catalog Number:
AG01FF2K
Chemical Name:
4-Fluoro-2-n-pentoxythiophenol
CAS Number:
1443311-43-0
Molecular Formula:
C11H15FOS
Molecular Weight:
214.2996
IUPAC Name:
4-fluoro-2-pentoxybenzenethiol
InChI:
InChI=1S/C11H15FOS/c1-2-3-4-7-13-10-8-9(12)5-6-11(10)14/h5-6,8,14H,2-4,7H2,1H3
InChI Key:
WPVXNKOOVYIBGD-UHFFFAOYSA-N
SMILES:
CCCCCOc1cc(F)ccc1S
Properties
Complexity:
154
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:
5
Topological Polar Surface Area:
10.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9
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