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Home > Fluorides > 1443336-75-1
1443336-75-1 | 3,5-Difluoro-2-iso-pentoxythiophenol
CAS No: 1443336-75-1 Catalog No: AG01FDL8 MDL No:
Product Description
Catalog Number:
AG01FDL8
Chemical Name:
3,5-Difluoro-2-iso-pentoxythiophenol
CAS Number:
1443336-75-1
Molecular Formula:
C11H14F2OS
Molecular Weight:
232.2901
IUPAC Name:
3,5-difluoro-2-(3-methylbutoxy)benzenethiol
InChI:
InChI=1S/C11H14F2OS/c1-7(2)3-4-14-11-9(13)5-8(12)6-10(11)15/h5-7,15H,3-4H2,1-2H3
InChI Key:
BCEIGDLXQIVIDP-UHFFFAOYSA-N
SMILES:
CC(CCOc1c(F)cc(cc1S)F)C
Properties
Complexity:
189
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
232.073g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
232.289g/mol
Monoisotopic Mass:
232.073g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
10.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9
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