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1378525-15-5 | 3,5-Difluoro-4-ethoxythiophenol
CAS No: 1378525-15-5 Catalog No: AG01FEVR MDL No:
Product Description
Catalog Number:
AG01FEVR
Chemical Name:
3,5-Difluoro-4-ethoxythiophenol
CAS Number:
1378525-15-5
Molecular Formula:
C8H8F2OS
Molecular Weight:
190.2103
IUPAC Name:
4-ethoxy-3,5-difluorobenzenethiol
InChI:
InChI=1S/C8H8F2OS/c1-2-11-8-6(9)3-5(12)4-7(8)10/h3-4,12H,2H2,1H3
InChI Key:
RXOTYWPBWVENRY-UHFFFAOYSA-N
SMILES:
CCOc1c(F)cc(cc1F)S
Properties
Complexity:
133
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
190.026g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
190.208g/mol
Monoisotopic Mass:
190.026g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
10.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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